2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(3-methylbutylcarbamoyl)ethanamide

Systemtic Name: 2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(3-methylbutylcarbamoyl)ethanamide Openeye Name: 2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-(isopentylcarbamoyl)acetamide CAS Name: 2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-[(3-methylbutylamino)-oxomethyl]acetamide IUPAC Name: 2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-(3-methylbutylcarbamoyl)acetamide Traditional Name: 2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-(isoamylcarbamoyl)acetamide Formula: C21H28N4O3S MolecularWeight: 416.53702

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3CCCC3

Isomeric SMILES

CC(C)CCNC(=O)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1C3CCCC3

InChI

InChI=1S/C21H28N4O3S/c1-14(2)11-12-22-20(28)24-18(26)13-29-21-23-17-10-6-5-9-16(17)19(27)25(21)15-7-3-4-8-15/h5-6,9-10,14-15H,3-4,7-8,11-13H2,1-2H3,(H2,22,24,26,28)