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

Systemtic Name: N-phenyl-2-[2-[[4-(phenylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoylamino]benzamide Openeye Name: 2-[[2-[[4-benzyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]-N-phenyl-benzamide CAS Name: 2-[[1-oxo-2-[[4-(phenylmethyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]ethyl]amino]-N-phenylbenzamide IUPAC Name: 2-[[2-[(4-benzyl-5-pyridin-3-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]-N-phenylbenzamide Traditional Name: 2-[[2-[[4-benzyl-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]-N-phenyl-benzamide Formula: C29H24N6O2S MolecularWeight: 520.60486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=NN=C2SCC(=O)NC3=CC=CC=C3C(=O)NC4=CC=CC=C4)C5=CN=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=NN=C2SCC(=O)NC3=CC=CC=C3C(=O)NC4=CC=CC=C4)C5=CN=CC=C5

InChI

InChI=1S/C29H24N6O2S/c36-26(32-25-16-8-7-15-24(25)28(37)31-23-13-5-2-6-14-23)20-38-29-34-33-27(22-12-9-17-30-18-22)35(29)19-21-10-3-1-4-11-21/h1-18H,19-20H2,(H,31,37)(H,32,36)