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

Systemtic Name: 4-[3-(diphenylmethyl)sulfanyl-5-propyl-1,2,4-triazol-4-yl]-N,N-dimethyl-aniline Openeye Name: 4-(3-benzhydrylsulfanyl-5-propyl-1,2,4-triazol-4-yl)-N,N-dimethyl-aniline CAS Name: 4-[3-[(diphenylmethyl)thio]-5-propyl-1,2,4-triazol-4-yl]-N,N-dimethylaniline IUPAC Name: 4-(3-benzhydrylsulfanyl-5-propyl-1,2,4-triazol-4-yl)-N,N-dimethylaniline Traditional Name: [4-[3-(benzhydrylthio)-5-propyl-1,2,4-triazol-4-yl]phenyl]-dimethyl-amine Formula: C26H28N4S MolecularWeight: 428.59232

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1C2=CC=C(C=C2)N(C)C)SC(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CCCC1=NN=C(N1C2=CC=C(C=C2)N(C)C)SC(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H28N4S/c1-4-11-24-27-28-26(30(24)23-18-16-22(17-19-23)29(2)3)31-25(20-12-7-5-8-13-20)21-14-9-6-10-15-21/h5-10,12-19,25H,4,11H2,1-3H3