1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane

C142H172F4N28O8S — CID 167710917

About 1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane

1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane (PubChem CID 167710917) has the molecular formula C142H172F4N28O8S and a molecular weight of 2507.18 g/mol. Its IUPAC name is 1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane.

Molecular Properties

• Compound Name: 1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane
• PubChem CID: 167710917
• Molecular Formula: C142H172F4N28O8S
• Molecular Weight: 2507.18 g/mol
• Exact Mass: 2505.36
• IUPAC Name: 1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane
• SMILES: S.[C-]#[N+]CC1CN(c2nc(OCCN(C)C3CC(F)(F)C3)nc3c2CCN(c2cccc4cccc(C)c24)C3)CCN1C(=O)C=C.[C-]#[N+]CC1CN(c2nc(OCCN(C)CC3CC(F)(F)C3)nc3c2CCN(c2cccc4cccc(C)c24)C3)CCN1C(=O)C=C.[C-]#[N+]CC1CN(c2nc(OCCN(C)CC3CCC3)nc3c2CCN(c2cccc4cccc(C)c24)C3)CCN1C(=O)C=C.[C-]#[N+]CC1CN(c2nc(O[C@@H](C)CN(CC3CC3)CC3CC3)nc3c2CCN(c2cccc4cccc(C)c24)C3)CCN1C(=O)C=C
• InChI: InChI=1S/C38H47N7O2.C35H41F2N7O2.C35H43N7O2.C34H39F2N7O2.H2S/c1-5-35(46)45-19-18-44(24-31(45)20-39-4)37-32-16-17-43(34-11-7-10-30-9-6-8-26(2)36(30)34)25-33(32)40-38(41-37)47-27(3)21-42(22-28-12-13-28)23-29-14-15-29;1-5-31(45)44-15-14-43(22-27(44)20-38-3)33-28-12-13-42(30-11-7-10-26-9-6-8-24(2)32(26)30)23-29(28)39-34(40-33)46-17-16-41(4)21-25-18-35(36,37)19-25;1-5-32(43)42-18-17-41(23-28(42)21-36-3)34-29-15-16-40(31-14-8-13-27-12-6-9-25(2)33(27)31)24-30(29)37-35(38-34)44-20-19-39(4)22-26-10-7-11-26;1-5-30(44)43-15-14-42(21-26(43)20-37-3)32-27-12-13-41(29-11-7-10-24-9-6-8-23(2)31(24)29)22-28(27)38-33(39-32)45-17-16-40(4)25-18-34(35,36)19-25;/h5-11,27-29,31H,1,12-25H2,2-3H3;5-11,25,27H,1,12-23H2,2,4H3;5-6,8-9,12-14,26,28H,1,7,10-11,15-24H2,2,4H3;5-11,25-26H,1,12-22H2,2,4H3;1H2/t27-,31?;;;;/m0..../s1
• InChIKey: ZVCCRZVYDMVXPJ-RUMCTLOYSA-N
• XLogP: 20.07
• TPSA: 277.60 Ų
• H-Bond Acceptors: 28
• Rotatable Bonds: 41
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2507.18
LogP ≤ 5	20.07
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane?

The IUPAC name of 1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane (CID 167710917) is 1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane.

What is the SMILES notation for 1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane?

The canonical SMILES for 1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane is S.[C-]#[N+]CC1CN(c2nc(OCCN(C)C3CC(F)(F)C3)nc3c2CCN(c2cccc4cccc(C)c24)C3)CCN1C(=O)C=C.[C-]#[N+]CC1CN(c2nc(OCCN(C)CC3CC(F)(F)C3)nc3c2CCN(c2cccc4cccc(C)c24)C3)CCN1C(=O)C=C.[C-]#[N+]CC1CN(c2nc(OCCN(C)CC3CCC3)nc3c2CCN(c2cccc4cccc(C)c24)C3)CCN1C(=O)C=C.[C-]#[N+]CC1CN(c2nc(O[C@@H](C)CN(CC3CC3)CC3CC3)nc3c2CCN(c2cccc4cccc(C)c24)C3)CCN1C(=O)C=C.

What is the InChIKey of 1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane?

The InChIKey is ZVCCRZVYDMVXPJ-RUMCTLOYSA-N. The full InChI is InChI=1S/C38H47N7O2.C35H41F2N7O2.C35H43N7O2.C34H39F2N7O2.H2S/c1-5-35(46)45-19-18-44(24-31(45)20-39-4)37-32-16-17-43(34-11-7-10-30-9-6-8-26(2)36(30)34)25-33(32)40-38(41-37)47-27(3)21-42(22-28-12-13-28)23-29-14-15-29;1-5-31(45)44-15-14-43(22-27(44)20-38-3)33-28-12-13-42(30-11-7-10-26-9-6-8-24(2)32(26)30)23-29(28)39-34(40-33)46-17-16-41(4)21-25-18-35(36,37)19-25;1-5-32(43)42-18-17-41(23-28(42)21-36-3)34-29-15-16-40(31-14-8-13-27-12-6-9-25(2)33(27)31)24-30(29)37-35(38-34)44-20-19-39(4)22-26-10-7-11-26;1-5-30(44)43-15-14-42(21-26(43)20-37-3)32-27-12-13-41(29-11-7-10-24-9-6-8-23(2)31(24)29)22-28(27)38-33(39-32)45-17-16-40(4)25-18-34(35,36)19-25;/h5-11,27-29,31H,1,12-25H2,2-3H3;5-11,25,27H,1,12-23H2,2,4H3;5-6,8-9,12-14,26,28H,1,7,10-11,15-24H2,2,4H3;5-11,25-26H,1,12-22H2,2,4H3;1H2/t27-,31?;;;;/m0..../s1.

What are the key properties of 1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane?

1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane has a molecular weight of 2507.18 g/mol, XLogP of 20.07, 41 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 1-[4-[2-[(2S)-1-[bis(cyclopropylmethyl)amino]propan-2-yl]oxy-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[cyclobutylmethyl(methyl)amino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;1-[4-[2-[2-[(3,3-difluorocyclobutyl)methyl-methylamino]ethoxy]-7-(8-methylnaphthalen-1-yl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]-2-(isocyanomethyl)piperazin-1-yl]prop-2-en-1-one;sulfane is sourced from PubChem (CID 167710917), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).