4-[[[2-[(4-chlorophenyl)carbamoyl]thiophen-3-yl]amino]methyl]pyridine-2-carboxylic acid

Systemtic Name: 4-[[[2-[(4-chlorophenyl)carbamoyl]thiophen-3-yl]amino]methyl]pyridine-2-carboxylic acid Openeye Name: 4-[[[2-[(4-chlorophenyl)carbamoyl]-3-thienyl]amino]methyl]pyridine-2-carboxylic acid CAS Name: 4-[[[2-[(4-chloroanilino)-oxomethyl]-3-thiophenyl]amino]methyl]-2-pyridinecarboxylic acid IUPAC Name: 4-[[[2-[(4-chlorophenyl)carbamoyl]thiophen-3-yl]amino]methyl]pyridine-2-carboxylic acid Traditional Name: 4-[[[2-[(4-chlorophenyl)carbamoyl]-3-thienyl]amino]methyl]picolinic acid Formula: C18H14ClN3O3S MolecularWeight: 387.84006

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=C(C=CS2)NCC3=CC(=NC=C3)C(=O)O)Cl

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=C(C=CS2)NCC3=CC(=NC=C3)C(=O)O)Cl

InChI

InChI=1S/C18H14ClN3O3S/c19-12-1-3-13(4-2-12)22-17(23)16-14(6-8-26-16)21-10-11-5-7-20-15(9-11)18(24)25/h1-9,21H,10H2,(H,22,23)(H,24,25)