2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2-(3,4-diethoxyphenyl)ethyl]ethanamide

Systemtic Name: 2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[2-(3,4-diethoxyphenyl)ethyl]ethanamide Openeye Name: 2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide CAS Name: 2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide IUPAC Name: 2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide Traditional Name: 2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-[2-(3,4-diethoxyphenyl)ethyl]acetamide Formula: C27H33N3O4S MolecularWeight: 495.63362

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)CCNC(=O)CSC2=NC3=CC=CC=C3C(=O)N2C4CCCC4)OCC

InChI

InChI=1S/C27H33N3O4S/c1-3-33-23-14-13-19(17-24(23)34-4-2)15-16-28-25(31)18-35-27-29-22-12-8-7-11-21(22)26(32)30(27)20-9-5-6-10-20/h7-8,11-14,17,20H,3-6,9-10,15-16,18H2,1-2H3,(H,28,31)