4-methoxy-N-[2-[[4-(phenylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]benzamide

Systemtic Name: 4-methoxy-N-[2-[[4-(phenylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl]benzamide Openeye Name: N-[2-[[4-benzyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-4-methoxy-benzamide CAS Name: 4-methoxy-N-[1-oxo-2-[[4-(phenylmethyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]ethyl]benzamide IUPAC Name: N-[2-[(4-benzyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]-4-methoxybenzamide Traditional Name: N-[2-[[4-benzyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]-4-methoxy-benzamide Formula: C24H21N5O3S MolecularWeight: 459.52024

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)NC(=O)CSC2=NN=C(N2CC3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C24H21N5O3S/c1-32-20-11-9-18(10-12-20)23(31)26-21(30)16-33-24-28-27-22(19-8-5-13-25-14-19)29(24)15-17-6-3-2-4-7-17/h2-14H,15-16H2,1H3,(H,26,30,31)