(2S)-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2-methylpropyl)propanamide

Systemtic Name: (2S)-2-(3-cyclopentyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-(2-methylpropyl)propanamide Openeye Name: (2S)-2-(3-cyclopentyl-4-oxo-quinazolin-2-yl)sulfanyl-N-isobutyl-propanamide CAS Name: (2S)-2-[(3-cyclopentyl-4-oxo-2-quinazolinyl)thio]-N-(2-methylpropyl)propanamide IUPAC Name: (2S)-2-(3-cyclopentyl-4-oxoquinazolin-2-yl)sulfanyl-N-(2-methylpropyl)propanamide Traditional Name: (2S)-2-[(3-cyclopentyl-4-keto-quinazolin-2-yl)thio]-N-isobutyl-propionamide Formula: C20H27N3O2S MolecularWeight: 373.51228

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)C(C)SC1=NC2=CC=CC=C2C(=O)N1C3CCCC3

Isomeric SMILES

C[C@@H](C(=O)NCC(C)C)SC1=NC2=CC=CC=C2C(=O)N1C3CCCC3

InChI

InChI=1S/C20H27N3O2S/c1-13(2)12-21-18(24)14(3)26-20-22-17-11-7-6-10-16(17)19(25)23(20)15-8-4-5-9-15/h6-7,10-11,13-15H,4-5,8-9,12H2,1-3H3,(H,21,24)/t14-/m0/s1