methyl 4-[[[4-(pyridin-2-ylcarbonylamino)thiophen-3-yl]carbonylamino]methyl]benzoate

Systemtic Name: methyl 4-[[[4-(pyridin-2-ylcarbonylamino)thiophen-3-yl]carbonylamino]methyl]benzoate Openeye Name: methyl 4-[[[4-(pyridine-2-carbonylamino)thiophene-3-carbonyl]amino]methyl]benzoate CAS Name: 4-[[[oxo-[4-[[oxo(2-pyridinyl)methyl]amino]-3-thiophenyl]methyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[4-(pyridine-2-carbonylamino)thiophene-3-carbonyl]amino]methyl]benzoate Traditional Name: 4-[[(4-picolinamidothiophene-3-carbonyl)amino]methyl]benzoic acid methyl ester Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CSC=C2NC(=O)C3=CC=CC=N3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)C2=CSC=C2NC(=O)C3=CC=CC=N3

InChI

InChI=1S/C20H17N3O4S/c1-27-20(26)14-7-5-13(6-8-14)10-22-18(24)15-11-28-12-17(15)23-19(25)16-4-2-3-9-21-16/h2-9,11-12H,10H2,1H3,(H,22,24)(H,23,25)