3-pyridin-4-yl-5-[(2,4,5-trimethylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine

Systemtic Name: 3-pyridin-4-yl-5-[(2,4,5-trimethylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Openeye Name: 3-(4-pyridyl)-5-[(2,4,5-trimethylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine CAS Name: 3-pyridin-4-yl-5-[(2,4,5-trimethylphenyl)methylthio]-1,2,4-triazol-4-amine IUPAC Name: 3-pyridin-4-yl-5-[(2,4,5-trimethylphenyl)methylsulfanyl]-1,2,4-triazol-4-amine Traditional Name: [3-(4-pyridyl)-5-[(2,4,5-trimethylbenzyl)thio]-1,2,4-triazol-4-yl]amine Formula: C17H19N5S MolecularWeight: 325.43126

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C)CSC2=NN=C(N2N)C3=CC=NC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1C)CSC2=NN=C(N2N)C3=CC=NC=C3)C

InChI

InChI=1S/C17H19N5S/c1-11-8-13(3)15(9-12(11)2)10-23-17-21-20-16(22(17)18)14-4-6-19-7-5-14/h4-9H,10,18H2,1-3H3