(4S,4aS)-4-phenyl-1-(phenylmethyl)-4a,5,6,7-tetrahydro-4H-3,1-benzothiazine-2-thione

Systemtic Name: (4S,4aS)-4-phenyl-1-(phenylmethyl)-4a,5,6,7-tetrahydro-4H-3,1-benzothiazine-2-thione Openeye Name: (4S,4aS)-1-benzyl-4-phenyl-4a,5,6,7-tetrahydro-4H-3,1-benzothiazine-2-thione CAS Name: (4S,4aS)-4-phenyl-1-(phenylmethyl)-4a,5,6,7-tetrahydro-4H-3,1-benzothiazine-2-thione IUPAC Name: (4S,4aS)-1-benzyl-4-phenyl-4a,5,6,7-tetrahydro-4H-3,1-benzothiazine-2-thione Traditional Name: (4S,4aS)-1-benzyl-4-phenyl-4a,5,6,7-tetrahydro-4H-3,1-benzothiazine-2-thione Formula: C21H21NS2 MolecularWeight: 351.52814

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=C2C(C1)C(SC(=S)N2CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1CC=C2[C@H](C1)[C@H](SC(=S)N2CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H21NS2/c23-21-22(15-16-9-3-1-4-10-16)19-14-8-7-13-18(19)20(24-21)17-11-5-2-6-12-17/h1-6,9-12,14,18,20H,7-8,13,15H2/t18-,20+/m0/s1