4-(3-methylphenyl)-5-phenyl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 4-(3-methylphenyl)-5-phenyl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 4-(m-tolyl)-5-phenyl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione CAS Name: 4-(3-methylphenyl)-5-phenyl-2-(1-pyrrolidinylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 4-(3-methylphenyl)-5-phenyl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 4-(m-tolyl)-5-phenyl-2-(pyrrolidinomethyl)-1,2,4-triazole-3-thione Formula: C20H22N4S MolecularWeight: 350.48048

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN(C2=S)CN3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN(C2=S)CN3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C20H22N4S/c1-16-8-7-11-18(14-16)24-19(17-9-3-2-4-10-17)21-23(20(24)25)15-22-12-5-6-13-22/h2-4,7-11,14H,5-6,12-13,15H2,1H3