N-[(2S)-butan-2-yl]-2-(4-oxidanylidene-3-phenylazanyl-quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(2S)-butan-2-yl]-2-(4-oxidanylidene-3-phenylazanyl-quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: 2-(3-anilino-4-oxo-quinazolin-2-yl)sulfanyl-N-[(1S)-1-methylpropyl]acetamide CAS Name: 2-[(3-anilino-4-oxo-2-quinazolinyl)thio]-N-[(2S)-butan-2-yl]acetamide IUPAC Name: 2-(3-anilino-4-oxoquinazolin-2-yl)sulfanyl-N-[(2S)-butan-2-yl]acetamide Traditional Name: 2-[(3-anilino-4-keto-quinazolin-2-yl)thio]-N-[(1S)-1-methylpropyl]acetamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1NC3=CC=CC=C3

Isomeric SMILES

CC[C@H](C)NC(=O)CSC1=NC2=CC=CC=C2C(=O)N1NC3=CC=CC=C3

InChI

InChI=1S/C20H22N4O2S/c1-3-14(2)21-18(25)13-27-20-22-17-12-8-7-11-16(17)19(26)24(20)23-15-9-5-4-6-10-15/h4-12,14,23H,3,13H2,1-2H3,(H,21,25)/t14-/m0/s1