N-(3-phenylmethoxypropyl)-2-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(3-phenylmethoxypropyl)-2-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(3-benzyloxypropyl)-2-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]acetamide CAS Name: N-(3-phenylmethoxypropyl)-2-[[4-phenyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: 2-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(3-phenylmethoxypropyl)acetamide Traditional Name: N-(3-benzoxypropyl)-2-[(5-benzyl-4-phenyl-1,2,4-triazol-3-yl)thio]acetamide Formula: C27H28N4O2S MolecularWeight: 472.60182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NCCCOCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CC2=NN=C(N2C3=CC=CC=C3)SCC(=O)NCCCOCC4=CC=CC=C4

InChI

InChI=1S/C27H28N4O2S/c32-26(28-17-10-18-33-20-23-13-6-2-7-14-23)21-34-27-30-29-25(19-22-11-4-1-5-12-22)31(27)24-15-8-3-9-16-24/h1-9,11-16H,10,17-21H2,(H,28,32)