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

Systemtic Name: N-[2-[7-cyano-3-(phenylmethyl)-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-1-yl]ethyl]methanesulfonamide Openeye Name: N-[2-(3-benzyl-7-cyano-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-1-yl)ethyl]methanesulfonamide CAS Name: N-[2-[7-cyano-3-(phenylmethyl)-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-1-yl]ethyl]methanesulfonamide IUPAC Name: N-[2-(3-benzyl-7-cyano-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-1-yl)ethyl]methanesulfonamide Traditional Name: N-[2-(3-benzyl-7-cyano-4-propylsulfonyl-3,5-dihydro-2H-1,4-benzodiazepin-1-yl)ethyl]methanesulfonamide Formula: C23H30N4O4S2 MolecularWeight: 490.6387

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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)CCNS(=O)(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C23H30N4O4S2/c1-3-13-33(30,31)27-17-21-14-20(16-24)9-10-23(21)26(12-11-25-32(2,28)29)18-22(27)15-19-7-5-4-6-8-19/h4-10,14,22,25H,3,11-13,15,17-18H2,1-2H3