(3aS,7aS)-3-(azepan-1-yl)-3a-oxidanyl-5,6,7,7a-tetrahydro-4H-1,3-benzothiazole-2-thione

Systemtic Name: (3aS,7aS)-3-(azepan-1-yl)-3a-oxidanyl-5,6,7,7a-tetrahydro-4H-1,3-benzothiazole-2-thione Openeye Name: (3aS,7aS)-3-(azepan-1-yl)-3a-hydroxy-5,6,7,7a-tetrahydro-4H-1,3-benzothiazole-2-thione CAS Name: (3aS,7aS)-3-(1-azepanyl)-3a-hydroxy-5,6,7,7a-tetrahydro-4H-1,3-benzothiazole-2-thione IUPAC Name: (3aS,7aS)-3-(azepan-1-yl)-3a-hydroxy-5,6,7,7a-tetrahydro-4H-1,3-benzothiazole-2-thione Traditional Name: (3aS,7aS)-3-(azepan-1-yl)-3a-hydroxy-5,6,7,7a-tetrahydro-4H-1,3-benzothiazole-2-thione Formula: C13H22N2OS2 MolecularWeight: 286.45658

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)N2C(=S)SC3C2(CCCC3)O

Isomeric SMILES

C1CCCN(CC1)N2C(=S)S[C@@H]3[C@]2(CCCC3)O

InChI

InChI=1S/C13H22N2OS2/c16-13-8-4-3-7-11(13)18-12(17)15(13)14-9-5-1-2-6-10-14/h11,16H,1-10H2/t11-,13-/m0/s1