methyl 6-[[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]carbamoyl]pyridine-3-carboxylate

Systemtic Name: methyl 6-[[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]carbamoyl]pyridine-3-carboxylate Openeye Name: methyl 6-[(5-benzyl-1,3,4-thiadiazol-2-yl)carbamoyl]pyridine-3-carboxylate CAS Name: 6-[oxo-[[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]amino]methyl]-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 6-[(5-benzyl-1,3,4-thiadiazol-2-yl)carbamoyl]pyridine-3-carboxylate Traditional Name: 6-[(5-benzyl-1,3,4-thiadiazol-2-yl)carbamoyl]nicotinic acid methyl ester Formula: C17H14N4O3S MolecularWeight: 354.38306

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=C(C=C1)C(=O)NC2=NN=C(S2)CC3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=CN=C(C=C1)C(=O)NC2=NN=C(S2)CC3=CC=CC=C3

InChI

InChI=1S/C17H14N4O3S/c1-24-16(23)12-7-8-13(18-10-12)15(22)19-17-21-20-14(25-17)9-11-5-3-2-4-6-11/h2-8,10H,9H2,1H3,(H,19,21,22)