4-(1H-benzimidazol-2-ylsulfanyl)-1-(4-cyclopropylcarbonylpiperazin-1-yl)butan-1-one

Systemtic Name: 4-(1H-benzimidazol-2-ylsulfanyl)-1-(4-cyclopropylcarbonylpiperazin-1-yl)butan-1-one Openeye Name: 4-(1H-benzimidazol-2-ylsulfanyl)-1-[4-(cyclopropanecarbonyl)piperazin-1-yl]butan-1-one CAS Name: 4-(1H-benzimidazol-2-ylthio)-1-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-1-butanone IUPAC Name: 4-(1H-benzimidazol-2-ylsulfanyl)-1-[4-(cyclopropanecarbonyl)piperazin-1-yl]butan-1-one Traditional Name: 4-(1H-benzimidazol-2-ylthio)-1-[4-(cyclopropanecarbonyl)piperazino]butan-1-one Formula: C19H24N4O2S MolecularWeight: 372.48446

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)C(=O)CCCSC3=NC4=CC=CC=C4N3

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)C(=O)CCCSC3=NC4=CC=CC=C4N3

InChI

InChI=1S/C19H24N4O2S/c24-17(22-9-11-23(12-10-22)18(25)14-7-8-14)6-3-13-26-19-20-15-4-1-2-5-16(15)21-19/h1-2,4-5,14H,3,6-13H2,(H,20,21)