3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-1-(4-cyclopropylcarbonylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-[[1,1-bis(oxidanylidene)-1,2-benzothiazol-3-yl]amino]-1-(4-cyclopropylcarbonylpiperazin-1-yl)propan-1-one Openeye Name: 1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propan-1-one CAS Name: 1-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]-3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]-1-propanone IUPAC Name: 1-[4-(cyclopropanecarbonyl)piperazin-1-yl]-3-[(1,1-dioxo-1,2-benzothiazol-3-yl)amino]propan-1-one Traditional Name: 1-[4-(cyclopropanecarbonyl)piperazino]-3-[(1,1-diketo-1,2-benzothiazol-3-yl)amino]propan-1-one Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)C(=O)CCNC3=NS(=O)(=O)C4=CC=CC=C43

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)C(=O)CCNC3=NS(=O)(=O)C4=CC=CC=C43

InChI

InChI=1S/C18H22N4O4S/c23-16(21-9-11-22(12-10-21)18(24)13-5-6-13)7-8-19-17-14-3-1-2-4-15(14)27(25,26)20-17/h1-4,13H,5-12H2,(H,19,20)