N-(4-methylphenyl)-2-(2-methylpropanoylamino)-4-oxidanylidene-thiochromene-3-carboxamide

Systemtic Name: N-(4-methylphenyl)-2-(2-methylpropanoylamino)-4-oxidanylidene-thiochromene-3-carboxamide Openeye Name: 2-(2-methylpropanoylamino)-4-oxo-N-(p-tolyl)thiochromene-3-carboxamide CAS Name: 2-[(2-methyl-1-oxopropyl)amino]-N-(4-methylphenyl)-4-oxo-1-benzothiopyran-3-carboxamide IUPAC Name: N-(4-methylphenyl)-2-(2-methylpropanoylamino)-4-oxothiochromene-3-carboxamide Traditional Name: 2-(isobutyrylamino)-4-keto-N-(p-tolyl)thiochromene-3-carboxamide Formula: C21H20N2O3S MolecularWeight: 380.4601

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=C(SC3=CC=CC=C3C2=O)NC(=O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=C(SC3=CC=CC=C3C2=O)NC(=O)C(C)C

InChI

InChI=1S/C21H20N2O3S/c1-12(2)19(25)23-21-17(18(24)15-6-4-5-7-16(15)27-21)20(26)22-14-10-8-13(3)9-11-14/h4-12H,1-3H3,(H,22,26)(H,23,25)