4-(2-methylpropoxy)-N-[[3-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-(2-methylpropoxy)-N-[[3-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]benzamide Openeye Name: 4-isobutoxy-N-[[3-(2-oxochromen-3-yl)phenyl]carbamothioyl]benzamide CAS Name: 4-(2-methylpropoxy)-N-[[3-(2-oxo-1-benzopyran-3-yl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-(2-methylpropoxy)-N-[[3-(2-oxochromen-3-yl)phenyl]carbamothioyl]benzamide Traditional Name: 4-isobutoxy-N-[[3-(2-ketochromen-3-yl)phenyl]thiocarbamoyl]benzamide Formula: C27H24N2O4S MolecularWeight: 472.55546

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C3=CC4=CC=CC=C4OC3=O

Isomeric SMILES

CC(C)COC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C3=CC4=CC=CC=C4OC3=O

InChI

InChI=1S/C27H24N2O4S/c1-17(2)16-32-22-12-10-18(11-13-22)25(30)29-27(34)28-21-8-5-7-19(14-21)23-15-20-6-3-4-9-24(20)33-26(23)31/h3-15,17H,16H2,1-2H3,(H2,28,29,30,34)