[4-[(2-methylphenyl)methyl]piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone

Systemtic Name: [4-[(2-methylphenyl)methyl]piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone Openeye Name: [4-(o-tolylmethyl)piperazin-1-yl]-(2-thioxo-1H-pyridin-3-yl)methanone CAS Name: [4-[(2-methylphenyl)methyl]-1-piperazinyl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone IUPAC Name: [4-[(2-methylphenyl)methyl]piperazin-1-yl]-(2-sulfanylidene-1H-pyridin-3-yl)methanone Traditional Name: [4-(2-methylbenzyl)piperazino]-(2-thioxo-1H-pyridin-3-yl)methanone Formula: C18H21N3OS MolecularWeight: 327.44384

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CC=CNC3=S

Isomeric SMILES

CC1=CC=CC=C1CN2CCN(CC2)C(=O)C3=CC=CNC3=S

InChI

InChI=1S/C18H21N3OS/c1-14-5-2-3-6-15(14)13-20-9-11-21(12-10-20)18(22)16-7-4-8-19-17(16)23/h2-8H,9-13H2,1H3,(H,19,23)