[(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum

C153H107F10N22O2Pt5-15 — CID 157179335

About [(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum

[(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum (PubChem CID 157179335) has the molecular formula C153H107F10N22O2Pt5-15 and a molecular weight of 3451.06 g/mol. Its IUPAC name is [(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum.

Molecular Properties

• Compound Name: [(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum
• PubChem CID: 157179335
• Molecular Formula: C153H107F10N22O2Pt5-15
• Molecular Weight: 3451.06 g/mol
• Exact Mass: 3448.71
• IUPAC Name: [(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum
• SMILES: CC(C)(C(=[N-])C(=CNc1[c-]cccc1)c1ccccc1)c1nn(-c2[c-]cccc2)cc1-c1ccccc1.CC(C)(C(=[N-])C=CNc1[c-]cc(F)cc1F)c1ccn(-c2[c-]cc(F)cc2F)n1.[C-]#[N+]/C(=C/Nc1[c-]cccc1)C(=[N-])C(C)(C)c1nn(-c2[c-]cccc2)cc1C#N.[N-]=C(/C=C\Nc1[c-]cc(C(F)(F)F)cc1)C(c1ccccc1)(c1ccccc1)c1ccn(-c2[c-]cc(C(F)(F)F)cc2)n1.[N-]=C(C=CNc1[c-]cc2oc3ccccc3c2c1)C(c1ccccc1)(c1ccccc1)c1ccn(-c2[c-]cc3oc4ccccc4c3c2)n1.[Pt].[Pt].[Pt].[Pt].[Pt]
• InChI: InChI=1S/C43H27N4O2.C33H21F6N4.C33H27N4.C23H17N6.C21H15F4N4.5Pt/c44-41(23-25-45-31-19-21-39-35(27-31)33-15-7-9-17-37(33)48-39)43(29-11-3-1-4-12-29,30-13-5-2-6-14-30)42-24-26-47(46-42)32-20-22-40-36(28-32)34-16-8-10-18-38(34)49-40;34-32(35,36)25-11-15-27(16-12-25)41-21-19-29(40)31(23-7-3-1-4-8-23,24-9-5-2-6-10-24)30-20-22-43(42-30)28-17-13-26(14-18-28)33(37,38)39;1-33(2,31(34)29(25-15-7-3-8-16-25)23-35-27-19-11-5-12-20-27)32-30(26-17-9-4-10-18-26)24-37(36-32)28-21-13-6-14-22-28;1-23(2,21(25)20(26-3)15-27-18-10-6-4-7-11-18)22-17(14-24)16-29(28-22)19-12-8-5-9-13-19;1-21(2,19(26)7-9-27-17-5-3-13(22)11-15(17)24)20-8-10-29(28-20)18-6-4-14(23)12-16(18)25;;;;;/h1-18,21-28,45H;1-15,17,19-22,41H;3-19,21,23-24,35H,1-2H3;4-10,12,15-16,27H,1-2H3;3-4,7-12,27H,1-2H3;;;;;/q5*-3;;;;;/b;21-19-;;20-15+
• InChIKey: WDRBZKBDHQLUFX-WWJIAYIWSA-N
• XLogP: 35.74
• TPSA: 315.18 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 18
• Rotatable Bonds: 36
• Heavy Atoms: 192
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	3451.06
LogP ≤ 5	35.74
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	18

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of [(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum?

The IUPAC name of [(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum (CID 157179335) is [(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum.

What is the SMILES notation for [(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum?

The canonical SMILES for [(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum is CC(C)(C(=[N-])C(=CNc1[c-]cccc1)c1ccccc1)c1nn(-c2[c-]cccc2)cc1-c1ccccc1.CC(C)(C(=[N-])C=CNc1[c-]cc(F)cc1F)c1ccn(-c2[c-]cc(F)cc2F)n1.[C-]#[N+]/C(=C/Nc1[c-]cccc1)C(=[N-])C(C)(C)c1nn(-c2[c-]cccc2)cc1C#N.[N-]=C(/C=C\Nc1[c-]cc(C(F)(F)F)cc1)C(c1ccccc1)(c1ccccc1)c1ccn(-c2[c-]cc(C(F)(F)F)cc2)n1.[N-]=C(C=CNc1[c-]cc2oc3ccccc3c2c1)C(c1ccccc1)(c1ccccc1)c1ccn(-c2[c-]cc3oc4ccccc4c3c2)n1.[Pt].[Pt].[Pt].[Pt].[Pt].

What is the InChIKey of [(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum?

The InChIKey is WDRBZKBDHQLUFX-WWJIAYIWSA-N. The full InChI is InChI=1S/C43H27N4O2.C33H21F6N4.C33H27N4.C23H17N6.C21H15F4N4.5Pt/c44-41(23-25-45-31-19-21-39-35(27-31)33-15-7-9-17-37(33)48-39)43(29-11-3-1-4-12-29,30-13-5-2-6-14-30)42-24-26-47(46-42)32-20-22-40-36(28-32)34-16-8-10-18-38(34)49-40;34-32(35,36)25-11-15-27(16-12-25)41-21-19-29(40)31(23-7-3-1-4-8-23,24-9-5-2-6-10-24)30-20-22-43(42-30)28-17-13-26(14-18-28)33(37,38)39;1-33(2,31(34)29(25-15-7-3-8-16-25)23-35-27-19-11-5-12-20-27)32-30(26-17-9-4-10-18-26)24-37(36-32)28-21-13-6-14-22-28;1-23(2,21(25)20(26-3)15-27-18-10-6-4-7-11-18)22-17(14-24)16-29(28-22)19-12-8-5-9-13-19;1-21(2,19(26)7-9-27-17-5-3-13(22)11-15(17)24)20-8-10-29(28-20)18-6-4-14(23)12-16(18)25;;;;;/h1-18,21-28,45H;1-15,17,19-22,41H;3-19,21,23-24,35H,1-2H3;4-10,12,15-16,27H,1-2H3;3-4,7-12,27H,1-2H3;;;;;/q5*-3;;;;;/b;21-19-;;20-15+;;;;;;.

What are the key properties of [(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum?

[(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum has a molecular weight of 3451.06 g/mol, XLogP of 35.74, 36 rotatable bonds, 5 hydrogen bond donors, and 18 hydrogen bond acceptors.

Where does this data come from?

All data for [(E)-1-(anilino)-4-(4-cyano-1-phenylpyrazol-3-yl)-2-isocyano-4-methylpent-1-en-3-ylidene]azanide;[1-(anilino)-4-methyl-2-phenyl-4-(4-phenyl-1-phenylpyrazol-3-yl)pent-1-en-3-ylidene]azanide;[4-(3H-dibenzofuran-3-id-2-ylamino)-1-[1-(3H-dibenzofuran-3-id-2-yl)pyrazol-3-yl]-1,1-diphenylbut-3-en-2-ylidene]azanide;[1-[(2,4-difluorobenzene-6-id-1-yl)amino]-4-[1-(2,4-difluorobenzene-6-id-1-yl)pyrazol-3-yl]-4-methylpent-1-en-3-ylidene]azanide;[(Z)-1,1-diphenyl-4-[[4-(trifluoromethyl)benzene-6-id-1-yl]amino]-1-[1-[4-(trifluoromethyl)benzene-6-id-1-yl]pyrazol-3-yl]but-3-en-2-ylidene]azanide;platinum is sourced from PubChem (CID 157179335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).