N-[2-[7-cyano-3-(phenylmethyl)-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-1-yl]ethyl]-N-oxidanyl-methanesulfonamide

Systemtic Name: N-[2-[7-cyano-3-(phenylmethyl)-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-1-yl]ethyl]-N-oxidanyl-methanesulfonamide Openeye Name: N-[2-(3-benzyl-7-cyano-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-1-yl)ethyl]-N-hydroxy-methanesulfonamide CAS Name: N-[2-[7-cyano-3-(phenylmethyl)-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-1-yl]ethyl]-N-hydroxymethanesulfonamide IUPAC Name: N-[2-(3-benzyl-7-cyano-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-1-yl)ethyl]-N-hydroxymethanesulfonamide Traditional Name: N-[2-(3-benzyl-7-cyano-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-1-yl)ethyl]-N-hydroxy-methanesulfonamide Formula: C23H30N4O5S2 MolecularWeight: 506.6381

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Descriptors Computed from Structure

Canonical SMILES:

CCCS(=O)(=O)N1CC2=C(C=CC(=C2)C#N)N(CC1CC3=CC=CC=C3)CCN(O)S(=O)(=O)C

Isomeric SMILES

CCCS(=O)(=O)N1CC2=C(C=CC(=C2)C#N)N(CC1CC3=CC=CC=C3)CCN(O)S(=O)(=O)C

InChI

InChI=1S/C23H30N4O5S2/c1-3-13-34(31,32)26-17-21-14-20(16-24)9-10-23(21)25(11-12-27(28)33(2,29)30)18-22(26)15-19-7-5-4-6-8-19/h4-10,14,22,28H,3,11-13,15,17-18H2,1-2H3