2,3-bis(chloranyl)-N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 2,3-bis(chloranyl)-N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: 2,3-dichloro-N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide CAS Name: 2,3-dichloro-N-[[3-methoxy-4-[(2-methyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2,3-dichloro-N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: 2,3-dichloro-N-[[4-(isobutyrylamino)-3-methoxy-phenyl]thiocarbamoyl]benzamide Formula: C19H19Cl2N3O3S MolecularWeight: 440.34346

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=C(C=C(C=C1)NC(=S)NC(=O)C2=C(C(=CC=C2)Cl)Cl)OC

Isomeric SMILES

CC(C)C(=O)NC1=C(C=C(C=C1)NC(=S)NC(=O)C2=C(C(=CC=C2)Cl)Cl)OC

InChI

InChI=1S/C19H19Cl2N3O3S/c1-10(2)17(25)23-14-8-7-11(9-15(14)27-3)22-19(28)24-18(26)12-5-4-6-13(20)16(12)21/h4-10H,1-3H3,(H,23,25)(H2,22,24,26,28)