3-[(4-methylpiperazin-1-yl)methyl]benzenecarbothioamide

Systemtic Name: 3-[(4-methylpiperazin-1-yl)methyl]benzenecarbothioamide Openeye Name: 3-[(4-methylpiperazin-1-yl)methyl]benzenecarbothioamide CAS Name: 3-[(4-methyl-1-piperazinyl)methyl]benzenecarbothioamide IUPAC Name: 3-[(4-methylpiperazin-1-yl)methyl]benzenecarbothioamide Traditional Name: 3-[(4-methylpiperazino)methyl]thiobenzamide Formula: C13H19N3S MolecularWeight: 249.37506

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC=CC(=C2)C(=S)N

Isomeric SMILES

CN1CCN(CC1)CC2=CC=CC(=C2)C(=S)N

InChI

InChI=1S/C13H19N3S/c1-15-5-7-16(8-6-15)10-11-3-2-4-12(9-11)13(14)17/h2-4,9H,5-8,10H2,1H3,(H2,14,17)