N,N-diethyl-2-[8-(hydroxymethyl)-4a,8-dimethyl-2-(methylamino)-7-oxidanyl-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-4-yl]ethanamide

Systemtic Name: N,N-diethyl-2-[8-(hydroxymethyl)-4a,8-dimethyl-2-(methylamino)-7-oxidanyl-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-4-yl]ethanamide Openeye Name: N,N-diethyl-2-[7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-2-(methylamino)-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-4-yl]acetamide CAS Name: N,N-diethyl-2-[7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-2-(methylamino)-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-4-yl]acetamide IUPAC Name: N,N-diethyl-2-[7-hydroxy-8-(hydroxymethyl)-4a,8-dimethyl-2-(methylamino)-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-4-yl]acetamide Traditional Name: N,N-diethyl-2-[7-hydroxy-4a,8-dimethyl-2-(methylamino)-8-methylol-4,5,6,7,8a,9-hexahydrobenzo[f][1,3]benzothiazol-4-yl]acetamide Formula: C21H35N3O3S MolecularWeight: 409.5859

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)CC1C2=C(CC3C1(CCC(C3(C)CO)O)C)SC(=N2)NC

Isomeric SMILES

CCN(CC)C(=O)CC1C2=C(CC3C1(CCC(C3(C)CO)O)C)SC(=N2)NC

InChI

InChI=1S/C21H35N3O3S/c1-6-24(7-2)17(27)10-13-18-14(28-19(22-5)23-18)11-15-20(13,3)9-8-16(26)21(15,4)12-25/h13,15-16,25-26H,6-12H2,1-5H3,(H,22,23)