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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=NC3=CC4=CC=CC=C4C=C3C(=O)N2C

Isomeric SMILES

C[C@H](C(=O)NCC1=CC=CC=C1)SC2=NC3=CC4=CC=CC=C4C=C3C(=O)N2C

InChI

InChI=1S/C23H21N3O2S/c1-15(21(27)24-14-16-8-4-3-5-9-16)29-23-25-20-13-18-11-7-6-10-17(18)12-19(20)22(28)26(23)2/h3-13,15H,14H2,1-2H3,(H,24,27)/t15-/m1/s1