3-[2-(3-benzamido-1-methylsulfonyl-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-5-yl)ethanoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 3-[2-(3-benzamido-1-methylsulfonyl-4-oxidanylidene-2,3-dihydro-1,5-benzodiazepin-5-yl)ethanoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 3-[[2-(3-benzamido-1-methylsulfonyl-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl)acetyl]amino]-4-oxo-butanoic acid CAS Name: 3-[[2-(3-benzamido-1-methylsulfonyl-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl)-1-oxoethyl]amino]-4-oxobutanoic acid IUPAC Name: 3-[[2-(3-benzamido-1-methylsulfonyl-4-oxo-2,3-dihydro-1,5-benzodiazepin-5-yl)acetyl]amino]-4-oxobutanoic acid Traditional Name: 3-[[2-(3-benzamido-4-keto-1-mesyl-2,3-dihydro-1,5-benzodiazepin-5-yl)acetyl]amino]-4-keto-butyric acid Formula: C23H24N4O8S MolecularWeight: 516.52366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CC(C(=O)N(C2=CC=CC=C21)CC(=O)NC(CC(=O)O)C=O)NC(=O)C3=CC=CC=C3

Isomeric SMILES

CS(=O)(=O)N1CC(C(=O)N(C2=CC=CC=C21)CC(=O)NC(CC(=O)O)C=O)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H24N4O8S/c1-36(34,35)27-12-17(25-22(32)15-7-3-2-4-8-15)23(33)26(18-9-5-6-10-19(18)27)13-20(29)24-16(14-28)11-21(30)31/h2-10,14,16-17H,11-13H2,1H3,(H,24,29)(H,25,32)(H,30,31)