3a-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-3-ethyl-1,4,5,6,7,7a-hexahydrobenzimidazol-2-one

Systemtic Name: 3a-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-3-ethyl-1,4,5,6,7,7a-hexahydrobenzimidazol-2-one Openeye Name: 3a-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-3-ethyl-1,4,5,6,7,7a-hexahydrobenzimidazol-2-one CAS Name: 3a-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]-3-ethyl-1,4,5,6,7,7a-hexahydrobenzimidazol-2-one IUPAC Name: 3a-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-3-ethyl-1,4,5,6,7,7a-hexahydrobenzimidazol-2-one Traditional Name: 3a-[4-(1,2-benzothiazol-3-yl)piperazino]-3-ethyl-1,4,5,6,7,7a-hexahydrobenzimidazol-2-one Formula: C20H27N5OS MolecularWeight: 385.52628

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)NC2C1(CCCC2)N3CCN(CC3)C4=NSC5=CC=CC=C54

Isomeric SMILES

CCN1C(=O)NC2C1(CCCC2)N3CCN(CC3)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C20H27N5OS/c1-2-25-19(26)21-17-9-5-6-10-20(17,25)24-13-11-23(12-14-24)18-15-7-3-4-8-16(15)27-22-18/h3-4,7-8,17H,2,5-6,9-14H2,1H3,(H,21,26)