methyl 5-methyl-2-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-methyl-2-[[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonylamino]thiophene-3-carboxylate Openeye Name: methyl 5-methyl-2-[[4-(2-pyridylmethyl)piperazine-1-carbonyl]amino]thiophene-3-carboxylate CAS Name: 5-methyl-2-[[oxo-[4-(2-pyridinylmethyl)-1-piperazinyl]methyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-methyl-2-[[4-(pyridin-2-ylmethyl)piperazine-1-carbonyl]amino]thiophene-3-carboxylate Traditional Name: 5-methyl-2-[[4-(2-pyridylmethyl)piperazine-1-carbonyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C18H22N4O3S MolecularWeight: 374.45728

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=O)N2CCN(CC2)CC3=CC=CC=N3)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=O)N2CCN(CC2)CC3=CC=CC=N3)C(=O)OC

InChI

InChI=1S/C18H22N4O3S/c1-13-11-15(17(23)25-2)16(26-13)20-18(24)22-9-7-21(8-10-22)12-14-5-3-4-6-19-14/h3-6,11H,7-10,12H2,1-2H3,(H,20,24)