2-[[cyclopropyl(pyridin-4-ylmethyl)amino]methyl]-4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazole-3-thione

Systemtic Name: 2-[[cyclopropyl(pyridin-4-ylmethyl)amino]methyl]-4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazole-3-thione Openeye Name: 4-benzyl-2-[[cyclopropyl(4-pyridylmethyl)amino]methyl]-5-(2-thienyl)-1,2,4-triazole-3-thione CAS Name: 2-[[cyclopropyl(pyridin-4-ylmethyl)amino]methyl]-4-(phenylmethyl)-5-thiophen-2-yl-1,2,4-triazole-3-thione IUPAC Name: 4-benzyl-2-[[cyclopropyl(pyridin-4-ylmethyl)amino]methyl]-5-thiophen-2-yl-1,2,4-triazole-3-thione Traditional Name: 4-benzyl-2-[[cyclopropyl(4-pyridylmethyl)amino]methyl]-5-(2-thienyl)-1,2,4-triazole-3-thione Formula: C23H23N5S2 MolecularWeight: 433.59222

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N(CC2=CC=NC=C2)CN3C(=S)N(C(=N3)C4=CC=CS4)CC5=CC=CC=C5

Isomeric SMILES

C1CC1N(CC2=CC=NC=C2)CN3C(=S)N(C(=N3)C4=CC=CS4)CC5=CC=CC=C5

InChI

InChI=1S/C23H23N5S2/c29-23-27(16-18-5-2-1-3-6-18)22(21-7-4-14-30-21)25-28(23)17-26(20-8-9-20)15-19-10-12-24-13-11-19/h1-7,10-14,20H,8-9,15-17H2