(2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate

Systemtic Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Openeye Name: [2-(2-thienyl)oxazol-4-yl]methyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate CAS Name: 2-(1,2,4-triazol-1-yl)-3-pyridinecarboxylic acid (2-thiophen-2-yl-4-oxazolyl)methyl ester IUPAC Name: (2-thiophen-2-yl-1,3-oxazol-4-yl)methyl 2-(1,2,4-triazol-1-yl)pyridine-3-carboxylate Traditional Name: 2-(1,2,4-triazol-1-yl)nicotinic acid [2-(2-thienyl)oxazol-4-yl]methyl ester Formula: C16H11N5O3S MolecularWeight: 353.35524

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(N=C1)N2C=NC=N2)C(=O)OCC3=COC(=N3)C4=CC=CS4

Isomeric SMILES

C1=CC(=C(N=C1)N2C=NC=N2)C(=O)OCC3=COC(=N3)C4=CC=CS4

InChI

InChI=1S/C16H11N5O3S/c22-16(12-3-1-5-18-14(12)21-10-17-9-19-21)24-8-11-7-23-15(20-11)13-4-2-6-25-13/h1-7,9-10H,8H2