2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(diphenylmethyl)propanamide

Systemtic Name: 2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(diphenylmethyl)propanamide Openeye Name: N-benzhydryl-2-[[4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: 2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-N-(diphenylmethyl)propanamide IUPAC Name: N-benzhydryl-2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-benzhydryl-2-[[4-cyclopropyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C26H26N4OS2 MolecularWeight: 474.64084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NN=C(N3C4CC4)CC5=CC=CS5

Isomeric SMILES

CC(C(=O)NC(C1=CC=CC=C1)C2=CC=CC=C2)SC3=NN=C(N3C4CC4)CC5=CC=CS5

InChI

InChI=1S/C26H26N4OS2/c1-18(25(31)27-24(19-9-4-2-5-10-19)20-11-6-3-7-12-20)33-26-29-28-23(30(26)21-14-15-21)17-22-13-8-16-32-22/h2-13,16,18,21,24H,14-15,17H2,1H3,(H,27,31)