4,6-dimethyl-1-[[4-[(3-methylphenyl)methyl]piperazin-1-yl]methyl]-2-sulfanylidene-pyridine-3-carbonitrile

Systemtic Name: 4,6-dimethyl-1-[[4-[(3-methylphenyl)methyl]piperazin-1-yl]methyl]-2-sulfanylidene-pyridine-3-carbonitrile Openeye Name: 4,6-dimethyl-1-[[4-(m-tolylmethyl)piperazin-1-yl]methyl]-2-thioxo-pyridine-3-carbonitrile CAS Name: 4,6-dimethyl-1-[[4-[(3-methylphenyl)methyl]-1-piperazinyl]methyl]-2-sulfanylidene-3-pyridinecarbonitrile IUPAC Name: 4,6-dimethyl-1-[[4-[(3-methylphenyl)methyl]piperazin-1-yl]methyl]-2-sulfanylidenepyridine-3-carbonitrile Traditional Name: 4,6-dimethyl-1-[[4-(3-methylbenzyl)piperazino]methyl]-2-thioxo-nicotinonitrile Formula: C21H26N4S MolecularWeight: 366.52294

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CN2CCN(CC2)CN3C(=CC(=C(C3=S)C#N)C)C

Isomeric SMILES

CC1=CC(=CC=C1)CN2CCN(CC2)CN3C(=CC(=C(C3=S)C#N)C)C

InChI

InChI=1S/C21H26N4S/c1-16-5-4-6-19(11-16)14-23-7-9-24(10-8-23)15-25-18(3)12-17(2)20(13-22)21(25)26/h4-6,11-12H,7-10,14-15H2,1-3H3