N-[[3-methyl-4-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[[3-methyl-4-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[[3-methyl-4-(2-oxochromen-3-yl)phenyl]carbamothioyl]thiophene-2-carboxamide CAS Name: N-[[3-methyl-4-(2-oxo-1-benzopyran-3-yl)anilino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[[3-methyl-4-(2-oxochromen-3-yl)phenyl]carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[[4-(2-ketochromen-3-yl)-3-methyl-phenyl]thiocarbamoyl]thiophene-2-carboxamide Formula: C22H16N2O3S2 MolecularWeight: 420.50404

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=CS2)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=CS2)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C22H16N2O3S2/c1-13-11-15(23-22(28)24-20(25)19-7-4-10-29-19)8-9-16(13)17-12-14-5-2-3-6-18(14)27-21(17)26/h2-12H,1H3,(H2,23,24,25,28)