4-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-propan-2-yl-butanamide

Systemtic Name: 4-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-propan-2-yl-butanamide Openeye Name: N-isopropyl-4-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]butanamide CAS Name: 4-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]-N-propan-2-ylbutanamide IUPAC Name: 4-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]-N-propan-2-ylbutanamide Traditional Name: N-isopropyl-4-[[4-(4-methoxyphenyl)-5-phenyl-1,2,4-triazol-3-yl]thio]butyramide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)CCCSC1=NN=C(N1C2=CC=C(C=C2)OC)C3=CC=CC=C3

Isomeric SMILES

CC(C)NC(=O)CCCSC1=NN=C(N1C2=CC=C(C=C2)OC)C3=CC=CC=C3

InChI

InChI=1S/C22H26N4O2S/c1-16(2)23-20(27)10-7-15-29-22-25-24-21(17-8-5-4-6-9-17)26(22)18-11-13-19(28-3)14-12-18/h4-6,8-9,11-14,16H,7,10,15H2,1-3H3,(H,23,27)