4-[3-cyclopropyl-5-(diphenylmethyl)sulfanyl-1,2,4-triazol-4-yl]-N,N-dimethyl-aniline

Systemtic Name: 4-[3-cyclopropyl-5-(diphenylmethyl)sulfanyl-1,2,4-triazol-4-yl]-N,N-dimethyl-aniline Openeye Name: 4-(3-benzhydrylsulfanyl-5-cyclopropyl-1,2,4-triazol-4-yl)-N,N-dimethyl-aniline CAS Name: 4-[3-cyclopropyl-5-[(diphenylmethyl)thio]-1,2,4-triazol-4-yl]-N,N-dimethylaniline IUPAC Name: 4-(3-benzhydrylsulfanyl-5-cyclopropyl-1,2,4-triazol-4-yl)-N,N-dimethylaniline Traditional Name: [4-[3-(benzhydrylthio)-5-cyclopropyl-1,2,4-triazol-4-yl]phenyl]-dimethyl-amine Formula: C26H26N4S MolecularWeight: 426.57644

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)N2C(=NN=C2SC(C3=CC=CC=C3)C4=CC=CC=C4)C5CC5

Isomeric SMILES

CN(C)C1=CC=C(C=C1)N2C(=NN=C2SC(C3=CC=CC=C3)C4=CC=CC=C4)C5CC5

InChI

InChI=1S/C26H26N4S/c1-29(2)22-15-17-23(18-16-22)30-25(21-13-14-21)27-28-26(30)31-24(19-9-5-3-6-10-19)20-11-7-4-8-12-20/h3-12,15-18,21,24H,13-14H2,1-2H3