(2S)-2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-N-(3-methylphenyl)propanamide

Systemtic Name: (2S)-2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-N-(3-methylphenyl)propanamide Openeye Name: (2S)-2-(3-methyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanyl-N-(m-tolyl)propanamide CAS Name: (2S)-2-[(3-methyl-4-oxo-2-benzo[g]quinazolinyl)thio]-N-(3-methylphenyl)propanamide IUPAC Name: (2S)-2-(3-methyl-4-oxobenzo[g]quinazolin-2-yl)sulfanyl-N-(3-methylphenyl)propanamide Traditional Name: (2S)-2-[(4-keto-3-methyl-benzo[g]quinazolin-2-yl)thio]-N-(m-tolyl)propionamide Formula: C23H21N3O2S MolecularWeight: 403.49674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)SC2=NC3=CC4=CC=CC=C4C=C3C(=O)N2C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)[C@H](C)SC2=NC3=CC4=CC=CC=C4C=C3C(=O)N2C

InChI

InChI=1S/C23H21N3O2S/c1-14-7-6-10-18(11-14)24-21(27)15(2)29-23-25-20-13-17-9-5-4-8-16(17)12-19(20)22(28)26(23)3/h4-13,15H,1-3H3,(H,24,27)/t15-/m0/s1