N-[(1R)-1-cyclopropylethyl]-2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-[(1R)-1-cyclopropylethyl]-2-(3-methyl-4-oxidanylidene-benzo[g]quinazolin-2-yl)sulfanyl-ethanamide Openeye Name: N-[(1R)-1-cyclopropylethyl]-2-(3-methyl-4-oxo-benzo[g]quinazolin-2-yl)sulfanyl-acetamide CAS Name: N-[(1R)-1-cyclopropylethyl]-2-[(3-methyl-4-oxo-2-benzo[g]quinazolinyl)thio]acetamide IUPAC Name: N-[(1R)-1-cyclopropylethyl]-2-(3-methyl-4-oxobenzo[g]quinazolin-2-yl)sulfanylacetamide Traditional Name: N-[(1R)-1-cyclopropylethyl]-2-[(4-keto-3-methyl-benzo[g]quinazolin-2-yl)thio]acetamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1CC1)NC(=O)CSC2=NC3=CC4=CC=CC=C4C=C3C(=O)N2C

Isomeric SMILES

C[C@H](C1CC1)NC(=O)CSC2=NC3=CC4=CC=CC=C4C=C3C(=O)N2C

InChI

InChI=1S/C20H21N3O2S/c1-12(13-7-8-13)21-18(24)11-26-20-22-17-10-15-6-4-3-5-14(15)9-16(17)19(25)23(20)2/h3-6,9-10,12-13H,7-8,11H2,1-2H3,(H,21,24)/t12-/m1/s1