3-chloranyl-N-[[(3-chlorophenyl)carbonylamino]carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[[(3-chlorophenyl)carbonylamino]carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[[(3-chlorobenzoyl)amino]carbamothioyl]-6-methoxy-benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[[[(3-chlorophenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-6-methoxy-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[[(3-chlorobenzoyl)amino]carbamothioyl]-6-methoxy-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[[(3-chlorobenzoyl)amino]thiocarbamoyl]-6-methoxy-benzothiophene-2-carboxamide Formula: C18H13Cl2N3O3S2 MolecularWeight: 454.35012

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)C3=CC(=CC=C3)Cl)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NC(=S)NNC(=O)C3=CC(=CC=C3)Cl)Cl

InChI

InChI=1S/C18H13Cl2N3O3S2/c1-26-11-5-6-12-13(8-11)28-15(14(12)20)17(25)21-18(27)23-22-16(24)9-3-2-4-10(19)7-9/h2-8H,1H3,(H,22,24)(H2,21,23,25,27)