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

Systemtic Name: 3-[3-[(4-tert-butylphenyl)methylsulfanyl]-5-pyridin-4-yl-1,2,4-triazol-4-yl]-N,N-dimethyl-propan-1-amine Openeye Name: 3-[3-[(4-tert-butylphenyl)methylsulfanyl]-5-(4-pyridyl)-1,2,4-triazol-4-yl]-N,N-dimethyl-propan-1-amine CAS Name: 3-[3-[(4-tert-butylphenyl)methylthio]-5-pyridin-4-yl-1,2,4-triazol-4-yl]-N,N-dimethyl-1-propanamine IUPAC Name: 3-[3-[(4-tert-butylphenyl)methylsulfanyl]-5-pyridin-4-yl-1,2,4-triazol-4-yl]-N,N-dimethylpropan-1-amine Traditional Name: 3-[3-[(4-tert-butylbenzyl)thio]-5-(4-pyridyl)-1,2,4-triazol-4-yl]propyl-dimethyl-amine Formula: C23H31N5S MolecularWeight: 409.59074

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N5S/c1-23(2,3)20-9-7-18(8-10-20)17-29-22-26-25-21(19-11-13-24-14-12-19)28(22)16-6-15-27(4)5/h7-14H,6,15-17H2,1-5H3