1-benzothiophen-3-ylmethyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate

Systemtic Name: 1-benzothiophen-3-ylmethyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Openeye Name: benzothiophen-3-ylmethyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate CAS Name: 2-(1,2,4-triazol-1-yl)-3-pyridinecarboxylic acid 1-benzothiophen-3-ylmethyl ester IUPAC Name: 1-benzothiophen-3-ylmethyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Traditional Name: 2-(1,2,4-triazol-1-yl)nicotinic acid benzothiophen-3-ylmethyl ester Formula: C17H12N4O2S MolecularWeight: 336.36778

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CS2)COC(=O)C3=C(N=CC=C3)N4C=NC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CS2)COC(=O)C3=C(N=CC=C3)N4C=NC=N4

InChI

InChI=1S/C17H12N4O2S/c22-17(14-5-3-7-19-16(14)21-11-18-10-20-21)23-8-12-9-24-15-6-2-1-4-13(12)15/h1-7,9-11H,8H2