2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]ethanamide

Systemtic Name: 2-(3-cyclopropyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2-(4-methoxyphenyl)-2-piperidin-1-yl-ethyl]ethanamide Openeye Name: 2-(3-cyclopropyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-(4-methoxyphenyl)-2-(1-piperidyl)ethyl]acetamide CAS Name: 2-[(3-cyclopropyl-4-oxo-2-quinazolinyl)thio]-N-[2-(4-methoxyphenyl)-2-(1-piperidinyl)ethyl]acetamide IUPAC Name: 2-(3-cyclopropyl-4-oxoquinazolin-2-yl)sulfanyl-N-[2-(4-methoxyphenyl)-2-piperidin-1-ylethyl]acetamide Traditional Name: 2-[(3-cyclopropyl-4-keto-quinazolin-2-yl)thio]-N-[2-(4-methoxyphenyl)-2-piperidino-ethyl]acetamide Formula: C27H32N4O3S MolecularWeight: 492.63298

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)N5CCCCC5

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CC4)N5CCCCC5

InChI

InChI=1S/C27H32N4O3S/c1-34-21-13-9-19(10-14-21)24(30-15-5-2-6-16-30)17-28-25(32)18-35-27-29-23-8-4-3-7-22(23)26(33)31(27)20-11-12-20/h3-4,7-10,13-14,20,24H,2,5-6,11-12,15-18H2,1H3,(H,28,32)