4-(4-chlorophenyl)-5-pyridin-4-yl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione

Systemtic Name: 4-(4-chlorophenyl)-5-pyridin-4-yl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione Openeye Name: 4-(4-chlorophenyl)-5-(4-pyridyl)-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione CAS Name: 4-(4-chlorophenyl)-5-pyridin-4-yl-2-(1-pyrrolidinylmethyl)-1,2,4-triazole-3-thione IUPAC Name: 4-(4-chlorophenyl)-5-pyridin-4-yl-2-(pyrrolidin-1-ylmethyl)-1,2,4-triazole-3-thione Traditional Name: 4-(4-chlorophenyl)-5-(4-pyridyl)-2-(pyrrolidinomethyl)-1,2,4-triazole-3-thione Formula: C18H18ClN5S MolecularWeight: 371.88702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CCN(C1)CN2C(=S)N(C(=N2)C3=CC=NC=C3)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C18H18ClN5S/c19-15-3-5-16(6-4-15)24-17(14-7-9-20-10-8-14)21-23(18(24)25)13-22-11-1-2-12-22/h3-10H,1-2,11-13H2