3-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-1-butyl-3a,4,5,6,7,7a-hexahydro-3H-indol-2-one

Systemtic Name: 3-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-1-butyl-3a,4,5,6,7,7a-hexahydro-3H-indol-2-one Openeye Name: 3-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-1-butyl-3a,4,5,6,7,7a-hexahydro-3H-indol-2-one CAS Name: 3-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]-1-butyl-3a,4,5,6,7,7a-hexahydro-3H-indol-2-one IUPAC Name: 3-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-1-butyl-3a,4,5,6,7,7a-hexahydro-3H-indol-2-one Traditional Name: 3-[4-(1,2-benzothiazol-3-yl)piperazino]-1-butyl-3a,4,5,6,7,7a-hexahydro-3H-indol-2-one Formula: C23H32N4OS MolecularWeight: 412.59138

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2CCCCC2C(C1=O)N3CCN(CC3)C4=NSC5=CC=CC=C54

Isomeric SMILES

CCCCN1C2CCCCC2C(C1=O)N3CCN(CC3)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C23H32N4OS/c1-2-3-12-27-19-10-6-4-8-17(19)21(23(27)28)25-13-15-26(16-14-25)22-18-9-5-7-11-20(18)29-24-22/h5,7,9,11,17,19,21H,2-4,6,8,10,12-16H2,1H3