3a-(4-piperidin-1-ylcarbonylpiperazin-1-yl)carbonyl-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazol-1-one

Systemtic Name: 3a-(4-piperidin-1-ylcarbonylpiperazin-1-yl)carbonyl-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazol-1-one Openeye Name: 3a-[4-(piperidine-1-carbonyl)piperazine-1-carbonyl]-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazol-1-one CAS Name: 3a-[oxo-[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]methyl]-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazol-1-one IUPAC Name: 3a-[4-(piperidine-1-carbonyl)piperazine-1-carbonyl]-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazol-1-one Traditional Name: 3a-[4-(piperidine-1-carbonyl)piperazine-1-carbonyl]-2,3-dihydropyrrolo[2,1-b][1,3]benzothiazol-1-one Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)N2CCN(CC2)C(=O)C34CCC(=O)N3C5=CC=CC=C5S4

Isomeric SMILES

C1CCN(CC1)C(=O)N2CCN(CC2)C(=O)C34CCC(=O)N3C5=CC=CC=C5S4

InChI

InChI=1S/C21H26N4O3S/c26-18-8-9-21(25(18)16-6-2-3-7-17(16)29-21)19(27)22-12-14-24(15-13-22)20(28)23-10-4-1-5-11-23/h2-3,6-7H,1,4-5,8-15H2