N-(4-methoxyphenyl)-4-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide

Systemtic Name: N-(4-methoxyphenyl)-4-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Openeye Name: 4-[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanylmethyl]-N-(4-methoxyphenyl)benzamide CAS Name: N-(4-methoxyphenyl)-4-[[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]methyl]benzamide IUPAC Name: N-(4-methoxyphenyl)-4-[(4-prop-2-enyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanylmethyl]benzamide Traditional Name: 4-[[[4-allyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]methyl]-N-(4-methoxyphenyl)benzamide Formula: C25H23N5O2S MolecularWeight: 457.54742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NN=C(N3CC=C)C4=CC=NC=C4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)CSC3=NN=C(N3CC=C)C4=CC=NC=C4

InChI

InChI=1S/C25H23N5O2S/c1-3-16-30-23(19-12-14-26-15-13-19)28-29-25(30)33-17-18-4-6-20(7-5-18)24(31)27-21-8-10-22(32-2)11-9-21/h3-15H,1,16-17H2,2H3,(H,27,31)