5-(2-dimethylaminoethyl)-3-ethylsulfonyl-11-methyl-benzo[b][1,4]benzodiazepin-6-one

Systemtic Name: 5-(2-dimethylaminoethyl)-3-ethylsulfonyl-11-methyl-benzo[b][1,4]benzodiazepin-6-one Openeye Name: 5-(2-dimethylaminoethyl)-3-ethylsulfonyl-11-methyl-benzo[b][1,4]benzodiazepin-6-one CAS Name: 5-(2-dimethylaminoethyl)-3-ethylsulfonyl-11-methyl-6-benzo[b][1,4]benzodiazepinone IUPAC Name: 5-(2-dimethylaminoethyl)-3-ethylsulfonyl-11-methylbenzo[b][1,4]benzodiazepin-6-one Traditional Name: 5-(2-dimethylaminoethyl)-3-esyl-11-methyl-benzo[b][1,4]benzodiazepin-6-one Formula: C20H25N3O3S MolecularWeight: 387.4958

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)N(C3=CC=CC=C3C(=O)N2CCN(C)C)C

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)N(C3=CC=CC=C3C(=O)N2CCN(C)C)C

InChI

InChI=1S/C20H25N3O3S/c1-5-27(25,26)15-10-11-18-19(14-15)23(13-12-21(2)3)20(24)16-8-6-7-9-17(16)22(18)4/h6-11,14H,5,12-13H2,1-4H3