N-[[3-methyl-4-(2-oxidanylidenechromen-3-yl)phenyl]carbamothioyl]-3-propan-2-yloxy-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H24N2O4S/c1-16(2)32-21-9-6-8-19(14-21)25(30)29-27(34)28-20-11-12-22(17(3)13-20)23-15-18-7-4-5-10-24(18)33-26(23)31/h4-16H,1-3H3,(H2,28,29,30,34)