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

Systemtic Name: N-[4-[2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]phenyl]-3-phenyl-propanamide Openeye Name: N-[4-[[2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]phenyl]-3-phenyl-propanamide CAS Name: N-[4-[[2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]amino]phenyl]-3-phenylpropanamide IUPAC Name: N-[4-[[2-[(4-ethyl-5-pyridin-4-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]phenyl]-3-phenylpropanamide Traditional Name: N-[4-[[2-[[4-ethyl-5-(4-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]phenyl]-3-phenyl-propionamide Formula: C26H26N6O2S MolecularWeight: 486.58864

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3)C4=CC=NC=C4

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)NC2=CC=C(C=C2)NC(=O)CCC3=CC=CC=C3)C4=CC=NC=C4

InChI

InChI=1S/C26H26N6O2S/c1-2-32-25(20-14-16-27-17-15-20)30-31-26(32)35-18-24(34)29-22-11-9-21(10-12-22)28-23(33)13-8-19-6-4-3-5-7-19/h3-7,9-12,14-17H,2,8,13,18H2,1H3,(H,28,33)(H,29,34)