3-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethoxy]benzenecarbothioamide

Systemtic Name: 3-[2-(4-methylpiperazin-1-yl)-2-oxidanylidene-ethoxy]benzenecarbothioamide Openeye Name: 3-[2-(4-methylpiperazin-1-yl)-2-oxo-ethoxy]benzenecarbothioamide CAS Name: 3-[2-(4-methyl-1-piperazinyl)-2-oxoethoxy]benzenecarbothioamide IUPAC Name: 3-[2-(4-methylpiperazin-1-yl)-2-oxoethoxy]benzenecarbothioamide Traditional Name: 3-[2-keto-2-(4-methylpiperazino)ethoxy]thiobenzamide Formula: C14H19N3O2S MolecularWeight: 293.38456

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)COC2=CC=CC(=C2)C(=S)N

Isomeric SMILES

CN1CCN(CC1)C(=O)COC2=CC=CC(=C2)C(=S)N

InChI

InChI=1S/C14H19N3O2S/c1-16-5-7-17(8-6-16)13(18)10-19-12-4-2-3-11(9-12)14(15)20/h2-4,9H,5-8,10H2,1H3,(H2,15,20)