(3R)-7-bromanyl-3-(cyclohexylmethyl)-4-methylsulfonyl-1,2,3,5-tetrahydro-1,4-benzodiazepine

Systemtic Name: (3R)-7-bromanyl-3-(cyclohexylmethyl)-4-methylsulfonyl-1,2,3,5-tetrahydro-1,4-benzodiazepine Openeye Name: (3R)-7-bromo-3-(cyclohexylmethyl)-4-methylsulfonyl-1,2,3,5-tetrahydro-1,4-benzodiazepine CAS Name: (3R)-7-bromo-3-(cyclohexylmethyl)-4-methylsulfonyl-1,2,3,5-tetrahydro-1,4-benzodiazepine IUPAC Name: (3R)-7-bromo-3-(cyclohexylmethyl)-4-methylsulfonyl-1,2,3,5-tetrahydro-1,4-benzodiazepine Traditional Name: (3R)-7-bromo-3-(cyclohexylmethyl)-4-mesyl-1,2,3,5-tetrahydro-1,4-benzodiazepine Formula: C17H25BrN2O2S MolecularWeight: 401.3616

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC2=C(C=CC(=C2)Br)NCC1CC3CCCCC3

Isomeric SMILES

CS(=O)(=O)N1CC2=C(C=CC(=C2)Br)NC[C@H]1CC3CCCCC3

InChI

InChI=1S/C17H25BrN2O2S/c1-23(21,22)20-12-14-10-15(18)7-8-17(14)19-11-16(20)9-13-5-3-2-4-6-13/h7-8,10,13,16,19H,2-6,9,11-12H2,1H3/t16-/m1/s1