(3aR,7aR)-3-(4-methylphenyl)sulfonyl-N-phenyl-3a,4,7,7a-tetrahydro-1,3-benzothiazol-2-imine

Systemtic Name: (3aR,7aR)-3-(4-methylphenyl)sulfonyl-N-phenyl-3a,4,7,7a-tetrahydro-1,3-benzothiazol-2-imine Openeye Name: (3aR,7aR)-N-phenyl-3-(p-tolylsulfonyl)-3a,4,7,7a-tetrahydro-1,3-benzothiazol-2-imine CAS Name: (3aR,7aR)-3-(4-methylphenyl)sulfonyl-N-phenyl-3a,4,7,7a-tetrahydro-1,3-benzothiazol-2-imine IUPAC Name: (3aR,7aR)-3-(4-methylphenyl)sulfonyl-N-phenyl-3a,4,7,7a-tetrahydro-1,3-benzothiazol-2-imine Traditional Name: [(3aR,7aR)-3-tosyl-3a,4,7,7a-tetrahydro-1,3-benzothiazol-2-ylidene]-phenyl-amine Formula: C20H20N2O2S2 MolecularWeight: 384.515

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C3CC=CCC3SC2=NC4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2[C@@H]3CC=CC[C@H]3SC2=NC4=CC=CC=C4

InChI

InChI=1S/C20H20N2O2S2/c1-15-11-13-17(14-12-15)26(23,24)22-18-9-5-6-10-19(18)25-20(22)21-16-7-3-2-4-8-16/h2-8,11-14,18-19H,9-10H2,1H3/t18-,19-/m1/s1