tert-butyl 2-[[2-cyclohexyl-2-(1-methylsulfonyl-5-oxidanylidene-2,3-dihydro-1,4-benzodiazepin-4-yl)ethanoyl]amino]ethanoate

Systemtic Name: tert-butyl 2-[[2-cyclohexyl-2-(1-methylsulfonyl-5-oxidanylidene-2,3-dihydro-1,4-benzodiazepin-4-yl)ethanoyl]amino]ethanoate Openeye Name: tert-butyl 2-[[2-cyclohexyl-2-(1-methylsulfonyl-5-oxo-2,3-dihydro-1,4-benzodiazepin-4-yl)acetyl]amino]acetate CAS Name: 2-[[2-cyclohexyl-2-(1-methylsulfonyl-5-oxo-2,3-dihydro-1,4-benzodiazepin-4-yl)-1-oxoethyl]amino]acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-[[2-cyclohexyl-2-(1-methylsulfonyl-5-oxo-2,3-dihydro-1,4-benzodiazepin-4-yl)acetyl]amino]acetate Traditional Name: 2-[[2-cyclohexyl-2-(5-keto-1-mesyl-2,3-dihydro-1,4-benzodiazepin-4-yl)acetyl]amino]acetic acid tert-butyl ester Formula: C24H35N3O6S MolecularWeight: 493.6162

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CNC(=O)C(C1CCCCC1)N2CCN(C3=CC=CC=C3C2=O)S(=O)(=O)C

Isomeric SMILES

CC(C)(C)OC(=O)CNC(=O)C(C1CCCCC1)N2CCN(C3=CC=CC=C3C2=O)S(=O)(=O)C

InChI

InChI=1S/C24H35N3O6S/c1-24(2,3)33-20(28)16-25-22(29)21(17-10-6-5-7-11-17)26-14-15-27(34(4,31)32)19-13-9-8-12-18(19)23(26)30/h8-9,12-13,17,21H,5-7,10-11,14-16H2,1-4H3,(H,25,29)