3,5-dimethyl-N-[[4-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3,5-dimethyl-N-[[4-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]benzamide Openeye Name: 3,5-dimethyl-N-[[4-(2-oxochromen-3-yl)phenyl]carbamothioyl]benzamide CAS Name: 3,5-dimethyl-N-[[4-(2-oxo-1-benzopyran-3-yl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3,5-dimethyl-N-[[4-(2-oxochromen-3-yl)phenyl]carbamothioyl]benzamide Traditional Name: N-[[4-(2-ketochromen-3-yl)phenyl]thiocarbamoyl]-3,5-dimethyl-benzamide Formula: C25H20N2O3S MolecularWeight: 428.5029

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3=CC4=CC=CC=C4OC3=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3=CC4=CC=CC=C4OC3=O)C

InChI

InChI=1S/C25H20N2O3S/c1-15-11-16(2)13-19(12-15)23(28)27-25(31)26-20-9-7-17(8-10-20)21-14-18-5-3-4-6-22(18)30-24(21)29/h3-14H,1-2H3,(H2,26,27,28,31)