5-[(Z)-C-methyl-N-[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]carbonimidoyl]thiophene-2-carboxylic acid

Systemtic Name: 5-[(Z)-C-methyl-N-[2-(2-oxidanylideneazepan-1-yl)ethanoylamino]carbonimidoyl]thiophene-2-carboxylic acid Openeye Name: 5-[(Z)-C-methyl-N-[[2-(2-oxoazepan-1-yl)acetyl]amino]carbonimidoyl]thiophene-2-carboxylic acid CAS Name: 5-[(1Z)-1-[[1-oxo-2-(2-oxo-1-azepanyl)ethyl]hydrazinylidene]ethyl]-2-thiophenecarboxylic acid IUPAC Name: 5-[(Z)-C-methyl-N-[[2-(2-oxoazepan-1-yl)acetyl]amino]carbonimidoyl]thiophene-2-carboxylic acid Traditional Name: 5-[(Z)-N-[[2-(2-ketoazepan-1-yl)acetyl]amino]-C-methyl-carbonimidoyl]-2-thenoic acid Formula: C15H19N3O4S MolecularWeight: 337.39406

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)CN1CCCCCC1=O)C2=CC=C(S2)C(=O)O

Isomeric SMILES

C/C(=N/NC(=O)CN1CCCCCC1=O)/C2=CC=C(S2)C(=O)O

InChI

InChI=1S/C15H19N3O4S/c1-10(11-6-7-12(23-11)15(21)22)16-17-13(19)9-18-8-4-2-3-5-14(18)20/h6-7H,2-5,8-9H2,1H3,(H,17,19)(H,21,22)/b16-10-