N-(1H-indol-5-yl)-N-[6-[2-(1-methyl-4-oxidanyl-piperidin-4-yl)ethynyl]quinazolin-4-yl]propane-1-sulfonamide

Systemtic Name: N-(1H-indol-5-yl)-N-[6-[2-(1-methyl-4-oxidanyl-piperidin-4-yl)ethynyl]quinazolin-4-yl]propane-1-sulfonamide Openeye Name: N-[6-[2-(4-hydroxy-1-methyl-4-piperidyl)ethynyl]quinazolin-4-yl]-N-(1H-indol-5-yl)propane-1-sulfonamide CAS Name: N-[6-[2-(4-hydroxy-1-methyl-4-piperidinyl)ethynyl]-4-quinazolinyl]-N-(1H-indol-5-yl)-1-propanesulfonamide IUPAC Name: N-[6-[2-(4-hydroxy-1-methylpiperidin-4-yl)ethynyl]quinazolin-4-yl]-N-(1H-indol-5-yl)propane-1-sulfonamide Traditional Name: N-[6-[2-(4-hydroxy-1-methyl-4-piperidyl)ethynyl]quinazolin-4-yl]-N-(1H-indol-5-yl)propane-1-sulfonamide Formula: C27H29N5O3S MolecularWeight: 503.61586

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N(C1=CC2=C(C=C1)NC=C2)C3=NC=NC4=C3C=C(C=C4)C#CC5(CCN(CC5)C)O

Isomeric SMILES

CCCS(=O)(=O)N(C1=CC2=C(C=C1)NC=C2)C3=NC=NC4=C3C=C(C=C4)C#CC5(CCN(CC5)C)O

InChI

InChI=1S/C27H29N5O3S/c1-3-16-36(34,35)32(22-5-7-24-21(18-22)9-13-28-24)26-23-17-20(4-6-25(23)29-19-30-26)8-10-27(33)11-14-31(2)15-12-27/h4-7,9,13,17-19,28,33H,3,11-12,14-16H2,1-2H3