5-[(E)-N-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-C-methyl-carbonimidoyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[(E)-N-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]-C-methyl-carbonimidoyl]thiophene-2-carboxylic acid Openeye Name: 5-[(E)-N-[(3-chlorobenzothiophene-2-carbonyl)amino]-C-methyl-carbonimidoyl]thiophene-2-carboxylic acid CAS Name: 5-[(1E)-1-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]hydrazinylidene]ethyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[(E)-N-[(3-chloro-1-benzothiophene-2-carbonyl)amino]-C-methylcarbonimidoyl]thiophene-2-carboxylic acid Traditional Name: 5-[(E)-N-[(3-chlorobenzothiophene-2-carbonyl)amino]-C-methyl-carbonimidoyl]-2-thenoic acid Formula: C16H11ClN2O3S2 MolecularWeight: 378.85314

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=C(C2=CC=CC=C2S1)Cl)C3=CC=C(S3)C(=O)O

Isomeric SMILES

C/C(=N\NC(=O)C1=C(C2=CC=CC=C2S1)Cl)/C3=CC=C(S3)C(=O)O

InChI

InChI=1S/C16H11ClN2O3S2/c1-8(10-6-7-12(23-10)16(21)22)18-19-15(20)14-13(17)9-4-2-3-5-11(9)24-14/h2-7H,1H3,(H,19,20)(H,21,22)/b18-8+