3-[4-(2-chlorophenyl)piperazin-1-yl]-3-oxidanylidene-propanethioamide

Systemtic Name: 3-[4-(2-chlorophenyl)piperazin-1-yl]-3-oxidanylidene-propanethioamide Openeye Name: 3-[4-(2-chlorophenyl)piperazin-1-yl]-3-oxo-propanethioamide CAS Name: 3-[4-(2-chlorophenyl)-1-piperazinyl]-3-oxopropanethioamide IUPAC Name: 3-[4-(2-chlorophenyl)piperazin-1-yl]-3-oxopropanethioamide Traditional Name: 3-[4-(2-chlorophenyl)piperazino]-3-keto-thiopropionamide Formula: C13H16ClN3OS MolecularWeight: 297.80364

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)CC(=S)N

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2Cl)C(=O)CC(=S)N

InChI

InChI=1S/C13H16ClN3OS/c14-10-3-1-2-4-11(10)16-5-7-17(8-6-16)13(18)9-12(15)19/h1-4H,5-9H2,(H2,15,19)