3-oxidanylidene-3-[4-(phenylmethyl)piperazin-1-yl]propanethioamide

Systemtic Name: 3-oxidanylidene-3-[4-(phenylmethyl)piperazin-1-yl]propanethioamide Openeye Name: 3-(4-benzylpiperazin-1-yl)-3-oxo-propanethioamide CAS Name: 3-oxo-3-[4-(phenylmethyl)-1-piperazinyl]propanethioamide IUPAC Name: 3-(4-benzylpiperazin-1-yl)-3-oxopropanethioamide Traditional Name: 3-(4-benzylpiperazino)-3-keto-thiopropionamide Formula: C14H19N3OS MolecularWeight: 277.38516

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=CC=CC=C2)C(=O)CC(=S)N

Isomeric SMILES

C1CN(CCN1CC2=CC=CC=C2)C(=O)CC(=S)N

InChI

InChI=1S/C14H19N3OS/c15-13(19)10-14(18)17-8-6-16(7-9-17)11-12-4-2-1-3-5-12/h1-5H,6-11H2,(H2,15,19)