N,N-dimethyl-3-[3-[(4-methylphenyl)methylsulfanyl]-5-pyridin-4-yl-1,2,4-triazol-4-yl]propan-1-amine

Systemtic Name: N,N-dimethyl-3-[3-[(4-methylphenyl)methylsulfanyl]-5-pyridin-4-yl-1,2,4-triazol-4-yl]propan-1-amine Openeye Name: N,N-dimethyl-3-[3-(p-tolylmethylsulfanyl)-5-(4-pyridyl)-1,2,4-triazol-4-yl]propan-1-amine CAS Name: N,N-dimethyl-3-[3-[(4-methylphenyl)methylthio]-5-pyridin-4-yl-1,2,4-triazol-4-yl]-1-propanamine IUPAC Name: N,N-dimethyl-3-[3-[(4-methylphenyl)methylsulfanyl]-5-pyridin-4-yl-1,2,4-triazol-4-yl]propan-1-amine Traditional Name: dimethyl-[3-[3-[(4-methylbenzyl)thio]-5-(4-pyridyl)-1,2,4-triazol-4-yl]propyl]amine Formula: C20H25N5S MolecularWeight: 367.511

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NN=C(N2CCCN(C)C)C3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NN=C(N2CCCN(C)C)C3=CC=NC=C3

InChI

InChI=1S/C20H25N5S/c1-16-5-7-17(8-6-16)15-26-20-23-22-19(18-9-11-21-12-10-18)25(20)14-4-13-24(2)3/h5-12H,4,13-15H2,1-3H3