1-(3-methylphenyl)-3-(4-methylpiperazin-1-yl)-2-pyridin-4-yl-3-sulfanylidene-propan-1-one

Systemtic Name: 1-(3-methylphenyl)-3-(4-methylpiperazin-1-yl)-2-pyridin-4-yl-3-sulfanylidene-propan-1-one Openeye Name: 3-(4-methylpiperazin-1-yl)-1-(m-tolyl)-2-(4-pyridyl)-3-thioxo-propan-1-one CAS Name: 1-(3-methylphenyl)-3-(4-methyl-1-piperazinyl)-2-pyridin-4-yl-3-sulfanylidene-1-propanone IUPAC Name: 1-(3-methylphenyl)-3-(4-methylpiperazin-1-yl)-2-pyridin-4-yl-3-sulfanylidenepropan-1-one Traditional Name: 3-(4-methylpiperazino)-1-(m-tolyl)-2-(4-pyridyl)-3-thioxo-propan-1-one Formula: C20H23N3OS MolecularWeight: 353.48112

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C(C2=CC=NC=C2)C(=S)N3CCN(CC3)C

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)C(C2=CC=NC=C2)C(=S)N3CCN(CC3)C

InChI

InChI=1S/C20H23N3OS/c1-15-4-3-5-17(14-15)19(24)18(16-6-8-21-9-7-16)20(25)23-12-10-22(2)11-13-23/h3-9,14,18H,10-13H2,1-2H3