methyl 1-[[4-chloranyl-3-[(E)-dimethylaminomethylideneamino]sulfonyl-phenyl]carbonylamino]-2-sulfanylidene-3H-benzimidazole-4-carboxylate

Systemtic Name: methyl 1-[[4-chloranyl-3-[(E)-dimethylaminomethylideneamino]sulfonyl-phenyl]carbonylamino]-2-sulfanylidene-3H-benzimidazole-4-carboxylate Openeye Name: methyl 1-[[4-chloro-3-[(E)-dimethylaminomethyleneamino]sulfonyl-benzoyl]amino]-2-thioxo-3H-benzimidazole-4-carboxylate CAS Name: 1-[[[4-chloro-3-[(E)-dimethylaminomethylideneamino]sulfonylphenyl]-oxomethyl]amino]-2-sulfanylidene-3H-benzimidazole-4-carboxylic acid methyl ester IUPAC Name: methyl 1-[[4-chloro-3-[(E)-dimethylaminomethylideneamino]sulfonylbenzoyl]amino]-2-sulfanylidene-3H-benzimidazole-4-carboxylate Traditional Name: 1-[[4-chloro-3-[(E)-dimethylaminomethyleneamino]sulfonyl-benzoyl]amino]-2-thioxo-3H-benzimidazole-4-carboxylic acid methyl ester Formula: C19H18ClN5O5S2 MolecularWeight: 495.95972

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C=NS(=O)(=O)C1=C(C=CC(=C1)C(=O)NN2C3=CC=CC(=C3NC2=S)C(=O)OC)Cl

Isomeric SMILES

CN(C)/C=N/S(=O)(=O)C1=C(C=CC(=C1)C(=O)NN2C3=CC=CC(=C3NC2=S)C(=O)OC)Cl

InChI

InChI=1S/C19H18ClN5O5S2/c1-24(2)10-21-32(28,29)15-9-11(7-8-13(15)20)17(26)23-25-14-6-4-5-12(18(27)30-3)16(14)22-19(25)31/h4-10H,1-3H3,(H,22,31)(H,23,26)/b21-10+