2-azanyl-1-(1-ethanoylpiperazin-2-yl)-3-(phenylmethylsulfanyl)propan-1-one

Systemtic Name: 2-azanyl-1-(1-ethanoylpiperazin-2-yl)-3-(phenylmethylsulfanyl)propan-1-one Openeye Name: 1-(1-acetylpiperazin-2-yl)-2-amino-3-benzylsulfanyl-propan-1-one CAS Name: 1-(1-acetyl-2-piperazinyl)-2-amino-3-(phenylmethylthio)-1-propanone IUPAC Name: 1-(1-acetylpiperazin-2-yl)-2-amino-3-benzylsulfanylpropan-1-one Traditional Name: 1-(1-acetylpiperazin-2-yl)-2-amino-3-(benzylthio)propan-1-one Formula: C16H23N3O2S MolecularWeight: 321.43772

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCNCC1C(=O)C(CSCC2=CC=CC=C2)N

Isomeric SMILES

CC(=O)N1CCNCC1C(=O)C(CSCC2=CC=CC=C2)N

InChI

InChI=1S/C16H23N3O2S/c1-12(20)19-8-7-18-9-15(19)16(21)14(17)11-22-10-13-5-3-2-4-6-13/h2-6,14-15,18H,7-11,17H2,1H3