2-[(3-chlorophenyl)carbamoylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid

Systemtic Name: 2-[(3-chlorophenyl)carbamoylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Openeye Name: 2-[(3-chlorophenyl)carbamoylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid CAS Name: 2-[[(3-chloroanilino)-oxomethyl]amino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid IUPAC Name: 2-[(3-chlorophenyl)carbamoylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Traditional Name: 2-[(3-chlorophenyl)carbamoylamino]-6-methyl-5,7-dihydro-4H-thieno[2,3-c]pyridine-3-carboxylic acid Formula: C16H16ClN3O3S MolecularWeight: 365.83454

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC2=C(C1)SC(=C2C(=O)O)NC(=O)NC3=CC(=CC=C3)Cl

Isomeric SMILES

CN1CCC2=C(C1)SC(=C2C(=O)O)NC(=O)NC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H16ClN3O3S/c1-20-6-5-11-12(8-20)24-14(13(11)15(21)22)19-16(23)18-10-4-2-3-9(17)7-10/h2-4,7H,5-6,8H2,1H3,(H,21,22)(H2,18,19,23)