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

Systemtic Name: N-[[4-[(2-chlorophenyl)carbonylamino]-3-methoxy-phenyl]carbamothioyl]thiophene-2-carboxamide Openeye Name: N-[[4-[(2-chlorobenzoyl)amino]-3-methoxy-phenyl]carbamothioyl]thiophene-2-carboxamide CAS Name: N-[[4-[[(2-chlorophenyl)-oxomethyl]amino]-3-methoxyanilino]-sulfanylidenemethyl]-2-thiophenecarboxamide IUPAC Name: N-[[4-[(2-chlorobenzoyl)amino]-3-methoxyphenyl]carbamothioyl]thiophene-2-carboxamide Traditional Name: N-[[4-[(2-chlorobenzoyl)amino]-3-methoxy-phenyl]thiocarbamoyl]thiophene-2-carboxamide Formula: C20H16ClN3O3S2 MolecularWeight: 445.94234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=CS2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=S)NC(=O)C2=CC=CS2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C20H16ClN3O3S2/c1-27-16-11-12(22-20(28)24-19(26)17-7-4-10-29-17)8-9-15(16)23-18(25)13-5-2-3-6-14(13)21/h2-11H,1H3,(H,23,25)(H2,22,24,26,28)