5-indol-3-ylidene-4-(3-methylphenyl)-2-[[methyl(2-pyridin-2-ylethyl)amino]methyl]-1,2,4-triazolidine-3-thione

Systemtic Name: 5-indol-3-ylidene-4-(3-methylphenyl)-2-[[methyl(2-pyridin-2-ylethyl)amino]methyl]-1,2,4-triazolidine-3-thione Openeye Name: 5-indol-3-ylidene-2-[[methyl-[2-(2-pyridyl)ethyl]amino]methyl]-4-(m-tolyl)-1,2,4-triazolidine-3-thione CAS Name: 5-(3-indolylidene)-4-(3-methylphenyl)-2-[[methyl-[2-(2-pyridinyl)ethyl]amino]methyl]-1,2,4-triazolidine-3-thione IUPAC Name: 5-indol-3-ylidene-4-(3-methylphenyl)-2-[[methyl(2-pyridin-2-ylethyl)amino]methyl]-1,2,4-triazolidine-3-thione Traditional Name: 5-indol-3-ylidene-2-[[methyl-[2-(2-pyridyl)ethyl]amino]methyl]-4-(m-tolyl)-1,2,4-triazolidine-3-thione Formula: C26H26N6S MolecularWeight: 454.58984

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=C3C=NC4=CC=CC=C43)NN(C2=S)CN(C)CCC5=CC=CC=N5

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=C3C=NC4=CC=CC=C43)NN(C2=S)CN(C)CCC5=CC=CC=N5

InChI

InChI=1S/C26H26N6S/c1-19-8-7-10-21(16-19)32-25(23-17-28-24-12-4-3-11-22(23)24)29-31(26(32)33)18-30(2)15-13-20-9-5-6-14-27-20/h3-12,14,16-17,29H,13,15,18H2,1-2H3