(3R)-7-phenyl-4-pyridin-3-ylsulfonyl-3-(thiophen-2-ylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine

Systemtic Name: (3R)-7-phenyl-4-pyridin-3-ylsulfonyl-3-(thiophen-2-ylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine Openeye Name: (3R)-7-phenyl-4-(3-pyridylsulfonyl)-3-(2-thienylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine CAS Name: (3R)-7-phenyl-4-(3-pyridinylsulfonyl)-3-(thiophen-2-ylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine IUPAC Name: (3R)-7-phenyl-4-pyridin-3-ylsulfonyl-3-(thiophen-2-ylmethyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine Traditional Name: (3R)-7-phenyl-4-(3-pyridylsulfonyl)-3-(2-thenyl)-1,2,3,5-tetrahydro-1,4-benzodiazepine Formula: C25H23N3O2S2 MolecularWeight: 461.59902

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N(CC2=C(N1)C=CC(=C2)C3=CC=CC=C3)S(=O)(=O)C4=CN=CC=C4)CC5=CC=CS5

Isomeric SMILES

C1[C@H](N(CC2=C(N1)C=CC(=C2)C3=CC=CC=C3)S(=O)(=O)C4=CN=CC=C4)CC5=CC=CS5

InChI

InChI=1S/C25H23N3O2S2/c29-32(30,24-9-4-12-26-17-24)28-18-21-14-20(19-6-2-1-3-7-19)10-11-25(21)27-16-22(28)15-23-8-5-13-31-23/h1-14,17,22,27H,15-16,18H2/t22-/m1/s1