3-[[5-(3,3-dimethyl-2-oxidanylidene-butyl)-4-oxidanylidene-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methyl-2-phenyl-propanoic acid

Systemtic Name: 3-[[5-(3,3-dimethyl-2-oxidanylidene-butyl)-4-oxidanylidene-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methyl-2-phenyl-propanoic acid Openeye Name: 3-[[5-(3,3-dimethyl-2-oxo-butyl)-4-oxo-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methyl-2-phenyl-propanoic acid CAS Name: 3-[[[[5-(3,3-dimethyl-2-oxobutyl)-4-oxo-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]amino]-oxomethyl]amino]-2-methyl-2-phenylpropanoic acid IUPAC Name: 3-[[5-(3,3-dimethyl-2-oxobutyl)-4-oxo-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methyl-2-phenylpropanoic acid Traditional Name: 3-[[4-keto-5-(2-keto-3,3-dimethyl-butyl)-1-phenyl-2,3-dihydro-1,5-benzodiazepin-3-yl]carbamoylamino]-2-methyl-2-phenyl-propionic acid Formula: C32H36N4O5 MolecularWeight: 556.65204

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)CN1C2=CC=CC=C2N(CC(C1=O)NC(=O)NCC(C)(C3=CC=CC=C3)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C(=O)CN1C2=CC=CC=C2N(CC(C1=O)NC(=O)NCC(C)(C3=CC=CC=C3)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C32H36N4O5/c1-31(2,3)27(37)20-36-26-18-12-11-17-25(26)35(23-15-9-6-10-16-23)19-24(28(36)38)34-30(41)33-21-32(4,29(39)40)22-13-7-5-8-14-22/h5-18,24H,19-21H2,1-4H3,(H,39,40)(H2,33,34,41)