2-[4-[(3,5-dimethyl-4-methylsulfanyl-phenyl)methyl]piperazin-1-yl]-N-ethyl-pyridin-3-amine

Systemtic Name: 2-[4-[(3,5-dimethyl-4-methylsulfanyl-phenyl)methyl]piperazin-1-yl]-N-ethyl-pyridin-3-amine Openeye Name: 2-[4-[(3,5-dimethyl-4-methylsulfanyl-phenyl)methyl]piperazin-1-yl]-N-ethyl-pyridin-3-amine CAS Name: 2-[4-[[3,5-dimethyl-4-(methylthio)phenyl]methyl]-1-piperazinyl]-N-ethyl-3-pyridinamine IUPAC Name: 2-[4-[(3,5-dimethyl-4-methylsulfanylphenyl)methyl]piperazin-1-yl]-N-ethylpyridin-3-amine Traditional Name: [2-[4-[3,5-dimethyl-4-(methylthio)benzyl]piperazino]-3-pyridyl]-ethyl-amine Formula: C21H30N4S MolecularWeight: 370.5547

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Descriptors Computed from Structure

Canonical SMILES:

CCNC1=C(N=CC=C1)N2CCN(CC2)CC3=CC(=C(C(=C3)C)SC)C

Isomeric SMILES

CCNC1=C(N=CC=C1)N2CCN(CC2)CC3=CC(=C(C(=C3)C)SC)C

InChI

InChI=1S/C21H30N4S/c1-5-22-19-7-6-8-23-21(19)25-11-9-24(10-12-25)15-18-13-16(2)20(26-4)17(3)14-18/h6-8,13-14,22H,5,9-12,15H2,1-4H3