5-[(Z)-N-(1H-indol-3-ylcarbonylamino)-C-methyl-carbonimidoyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[(Z)-N-(1H-indol-3-ylcarbonylamino)-C-methyl-carbonimidoyl]thiophene-2-carboxylic acid Openeye Name: 5-[(Z)-N-(1H-indole-3-carbonylamino)-C-methyl-carbonimidoyl]thiophene-2-carboxylic acid CAS Name: 5-[(1Z)-1-[[1H-indol-3-yl(oxo)methyl]hydrazinylidene]ethyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[(Z)-N-(1H-indole-3-carbonylamino)-C-methylcarbonimidoyl]thiophene-2-carboxylic acid Traditional Name: 5-[(Z)-N-(1H-indole-3-carbonylamino)-C-methyl-carbonimidoyl]-2-thenoic acid Formula: C16H13N3O3S MolecularWeight: 327.35772

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C1=CNC2=CC=CC=C21)C3=CC=C(S3)C(=O)O

Isomeric SMILES

C/C(=N/NC(=O)C1=CNC2=CC=CC=C21)/C3=CC=C(S3)C(=O)O

InChI

InChI=1S/C16H13N3O3S/c1-9(13-6-7-14(23-13)16(21)22)18-19-15(20)11-8-17-12-5-3-2-4-10(11)12/h2-8,17H,1H3,(H,19,20)(H,21,22)/b18-9-