N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]thiophene-2-carboxamide

Systemtic Name: N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]thiophene-2-carboxamide CAS Name: N-[[3-methoxy-4-[(2-methyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[[3-methoxy-4-(2-methylpropanoylamino)phenyl]carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[[4-(isobutyrylamino)-3-methoxy-phenyl]thiocarbamoyl]thiophene-2-carboxamide Formula: C17H19N3O3S2 MolecularWeight: 377.48106

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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=CC=CS2)OC

Isomeric SMILES

CC(C)C(=O)NC1=C(C=C(C=C1)NC(=S)NC(=O)C2=CC=CS2)OC

InChI

InChI=1S/C17H19N3O3S2/c1-10(2)15(21)19-12-7-6-11(9-13(12)23-3)18-17(24)20-16(22)14-5-4-8-25-14/h4-10H,1-3H3,(H,19,21)(H2,18,20,22,24)