(4aS,6S)-4a-(3-methoxyphenyl)-2,6-dimethyl-4,5,6,7-tetrahydro-3H-isoquinoline-1-thione

Systemtic Name: (4aS,6S)-4a-(3-methoxyphenyl)-2,6-dimethyl-4,5,6,7-tetrahydro-3H-isoquinoline-1-thione Openeye Name: (4aS,6S)-4a-(3-methoxyphenyl)-2,6-dimethyl-4,5,6,7-tetrahydro-3H-isoquinoline-1-thione CAS Name: (4aS,6S)-4a-(3-methoxyphenyl)-2,6-dimethyl-4,5,6,7-tetrahydro-3H-isoquinoline-1-thione IUPAC Name: (4aS,6S)-4a-(3-methoxyphenyl)-2,6-dimethyl-4,5,6,7-tetrahydro-3H-isoquinoline-1-thione Traditional Name: (4aS,6S)-4a-(3-methoxyphenyl)-2,6-dimethyl-4,5,6,7-tetrahydro-3H-isoquinoline-1-thione Formula: C18H23NOS MolecularWeight: 301.44632

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC=C2C(=S)N(CCC2(C1)C3=CC(=CC=C3)OC)C

Isomeric SMILES

C[C@H]1CC=C2C(=S)N(CC[C@@]2(C1)C3=CC(=CC=C3)OC)C

InChI

InChI=1S/C18H23NOS/c1-13-7-8-16-17(21)19(2)10-9-18(16,12-13)14-5-4-6-15(11-14)20-3/h4-6,8,11,13H,7,9-10,12H2,1-3H3/t13-,18+/m0/s1