(2S)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(1R)-1-phenylethyl]propanamide

Systemtic Name: (2S)-2-(3-methyl-4-oxidanylidene-quinazolin-2-yl)sulfanyl-N-[(1R)-1-phenylethyl]propanamide Openeye Name: (2S)-2-(3-methyl-4-oxo-quinazolin-2-yl)sulfanyl-N-[(1R)-1-phenylethyl]propanamide CAS Name: (2S)-2-[(3-methyl-4-oxo-2-quinazolinyl)thio]-N-[(1R)-1-phenylethyl]propanamide IUPAC Name: (2S)-2-(3-methyl-4-oxoquinazolin-2-yl)sulfanyl-N-[(1R)-1-phenylethyl]propanamide Traditional Name: (2S)-2-[(4-keto-3-methyl-quinazolin-2-yl)thio]-N-[(1R)-1-phenylethyl]propionamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=O)N2C

Isomeric SMILES

C[C@H](C1=CC=CC=C1)NC(=O)[C@H](C)SC2=NC3=CC=CC=C3C(=O)N2C

InChI

InChI=1S/C20H21N3O2S/c1-13(15-9-5-4-6-10-15)21-18(24)14(2)26-20-22-17-12-8-7-11-16(17)19(25)23(20)3/h4-14H,1-3H3,(H,21,24)/t13-,14+/m1/s1