4-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-cyclopropylcarbonylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-cyclopropylcarbonylpiperazin-1-yl)butan-1-one Openeye Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-1-[4-(cyclopropanecarbonyl)piperazin-1-yl]butan-1-one CAS Name: 4-(1,3-benzothiazol-2-ylthio)-1-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-1-butanone IUPAC Name: 4-(1,3-benzothiazol-2-ylsulfanyl)-1-[4-(cyclopropanecarbonyl)piperazin-1-yl]butan-1-one Traditional Name: 4-(1,3-benzothiazol-2-ylthio)-1-[4-(cyclopropanecarbonyl)piperazino]butan-1-one Formula: C19H23N3O2S2 MolecularWeight: 389.53482

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)C(=O)CCCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)C(=O)CCCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H23N3O2S2/c23-17(21-9-11-22(12-10-21)18(24)14-7-8-14)6-3-13-25-19-20-15-4-1-2-5-16(15)26-19/h1-2,4-5,14H,3,6-13H2