2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

C92H67N15O9S3 — CID 159804204

About 2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide

2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (PubChem CID 159804204) has the molecular formula C92H67N15O9S3 and a molecular weight of 1622.84 g/mol. Its IUPAC name is 2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

Molecular Properties

• Compound Name: 2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
• PubChem CID: 159804204
• Molecular Formula: C92H67N15O9S3
• Molecular Weight: 1622.84 g/mol
• Exact Mass: 1621.44
• IUPAC Name: 2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide
• SMILES: Cc1nc(C#Cc2cccc3oc(C(C)NC(=O)c4c(C)nn5cccnc45)c(-c4ccccc4)c(=O)c23)cs1.Cc1ncc(C#Cc2cccc3oc(C(C)NC(=O)c4c(C)nn5cccnc45)c(-c4ccccc4)c(=O)c23)s1.Cc1nn2cccnc2c1C(=O)NC(C)c1oc2cccc(C#Cc3cncs3)c2c(=O)c1-c1ccccc1
• InChI: InChI=1S/2C31H23N5O3S.C30H21N5O3S/c1-18-25(30-32-15-8-16-36(30)35-18)31(38)33-19(2)29-27(21-9-5-4-6-10-21)28(37)26-22(11-7-12-24(26)39-29)13-14-23-17-40-20(3)34-23;1-18-25(30-32-15-8-16-36(30)35-18)31(38)34-19(2)29-27(21-9-5-4-6-10-21)28(37)26-22(11-7-12-24(26)39-29)13-14-23-17-33-20(3)40-23;1-18-24(29-32-14-7-15-35(29)34-18)30(37)33-19(2)28-26(20-8-4-3-5-9-20)27(36)25-21(10-6-11-23(25)38-28)12-13-22-16-31-17-39-22/h4-12,15-17,19H,1-3H3,(H,33,38);4-12,15-17,19H,1-3H3,(H,34,38);3-11,14-17,19H,1-2H3,(H,33,37)
• InChIKey: NKEKNJDUJGNEFH-UHFFFAOYSA-N
• XLogP: 16.09
• TPSA: 307.17 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 24
• Rotatable Bonds: 12
• Heavy Atoms: 119
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1622.84
LogP ≤ 5	16.09
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'triple_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The IUPAC name of 2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide (CID 159804204) is 2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide.

What is the SMILES notation for 2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The canonical SMILES for 2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is Cc1nc(C#Cc2cccc3oc(C(C)NC(=O)c4c(C)nn5cccnc45)c(-c4ccccc4)c(=O)c23)cs1.Cc1ncc(C#Cc2cccc3oc(C(C)NC(=O)c4c(C)nn5cccnc45)c(-c4ccccc4)c(=O)c23)s1.Cc1nn2cccnc2c1C(=O)NC(C)c1oc2cccc(C#Cc3cncs3)c2c(=O)c1-c1ccccc1.

What is the InChIKey of 2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

The InChIKey is NKEKNJDUJGNEFH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C31H23N5O3S.C30H21N5O3S/c1-18-25(30-32-15-8-16-36(30)35-18)31(38)33-19(2)29-27(21-9-5-4-6-10-21)28(37)26-22(11-7-12-24(26)39-29)13-14-23-17-40-20(3)34-23;1-18-25(30-32-15-8-16-36(30)35-18)31(38)34-19(2)29-27(21-9-5-4-6-10-21)28(37)26-22(11-7-12-24(26)39-29)13-14-23-17-33-20(3)40-23;1-18-24(29-32-14-7-15-35(29)34-18)30(37)33-19(2)28-26(20-8-4-3-5-9-20)27(36)25-21(10-6-11-23(25)38-28)12-13-22-16-31-17-39-22/h4-12,15-17,19H,1-3H3,(H,33,38);4-12,15-17,19H,1-3H3,(H,34,38);3-11,14-17,19H,1-2H3,(H,33,37).

What are the key properties of 2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide?

2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide has a molecular weight of 1622.84 g/mol, XLogP of 16.09, 12 rotatable bonds, 3 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[5-[2-(2-methyl-1,3-thiazol-5-yl)ethynyl]-4-oxo-3-phenylchromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide;2-methyl-N-[1-[4-oxo-3-phenyl-5-[2-(1,3-thiazol-5-yl)ethynyl]chromen-2-yl]ethyl]pyrazolo[1,5-a]pyrimidine-3-carboxamide is sourced from PubChem (CID 159804204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).