6,8-dimethyl-2,3,4,6-tetrahydro-1H-5,1-benzothiazocine hydrochloride

Systemtic Name: 6,8-dimethyl-2,3,4,6-tetrahydro-1H-5,1-benzothiazocine hydrochloride Openeye Name: 6,8-dimethyl-2,3,4,6-tetrahydro-1H-5,1-benzothiazocine hydrochloride CAS Name: 6,8-dimethyl-2,3,4,6-tetrahydro-1H-5,1-benzothiazocine hydrochloride IUPAC Name: 6,8-dimethyl-2,3,4,6-tetrahydro-1H-5,1-benzothiazocine hydrochloride Traditional Name: 6,8-dimethyl-2,3,4,6-tetrahydro-1H-5,1-benzothiazocine hydrochloride Formula: C12H18ClNS MolecularWeight: 243.79602

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C=CC(=C2)C)NCCCS1.Cl

Isomeric SMILES

CC1C2=C(C=CC(=C2)C)NCCCS1.Cl

InChI

InChI=1S/C12H17NS.ClH/c1-9-4-5-12-11(8-9)10(2)14-7-3-6-13-12;/h4-5,8,10,13H,3,6-7H2,1-2H3;1H