N-[4-[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]-3-phenyl-propanamide

Systemtic Name: N-[4-[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]-3-phenyl-propanamide Openeye Name: N-[4-[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]-3-phenyl-propanamide CAS Name: N-[4-[4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]phenyl]-3-phenylpropanamide IUPAC Name: N-[4-[4-methyl-5-(2-phenoxyethylsulfanyl)-1,2,4-triazol-3-yl]phenyl]-3-phenylpropanamide Traditional Name: N-[4-[4-methyl-5-(2-phenoxyethylthio)-1,2,4-triazol-3-yl]phenyl]-3-phenyl-propionamide Formula: C26H26N4O2S MolecularWeight: 458.57524

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NN=C1SCCOC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CCC4=CC=CC=C4

Isomeric SMILES

CN1C(=NN=C1SCCOC2=CC=CC=C2)C3=CC=C(C=C3)NC(=O)CCC4=CC=CC=C4

InChI

InChI=1S/C26H26N4O2S/c1-30-25(28-29-26(30)33-19-18-32-23-10-6-3-7-11-23)21-13-15-22(16-14-21)27-24(31)17-12-20-8-4-2-5-9-20/h2-11,13-16H,12,17-19H2,1H3,(H,27,31)