N-(2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl)-5-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]pentanamide

Systemtic Name: N-(2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl)-5-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]pentanamide Openeye Name: N-(2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl)-5-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]pentanamide CAS Name: N-(2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl)-5-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]pentanamide IUPAC Name: N-(2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl)-5-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]pentanamide Traditional Name: N-(2,2-dimethyl-4-phenyl-1,3-dioxan-5-yl)-5-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]valeramide Formula: C32H36N4O4S MolecularWeight: 572.71764

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCC(C(O1)C2=CC=CC=C2)NC(=O)CCCCSC3=NN=C(N3C4=CC=C(C=C4)OC)C5=CC=CC=C5)C

Isomeric SMILES

CC1(OCC(C(O1)C2=CC=CC=C2)NC(=O)CCCCSC3=NN=C(N3C4=CC=C(C=C4)OC)C5=CC=CC=C5)C

InChI

InChI=1S/C32H36N4O4S/c1-32(2)39-22-27(29(40-32)23-12-6-4-7-13-23)33-28(37)16-10-11-21-41-31-35-34-30(24-14-8-5-9-15-24)36(31)25-17-19-26(38-3)20-18-25/h4-9,12-15,17-20,27,29H,10-11,16,21-22H2,1-3H3,(H,33,37)