[2-methyl-3-(1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)-1-oxidanylidene-1-(phenethylamino)propan-2-yl]carbamic acid

Systemtic Name: [2-methyl-3-(1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)-1-oxidanylidene-1-(phenethylamino)propan-2-yl]carbamic acid Openeye Name: [1-methyl-1-[(1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]-2-oxo-2-(phenethylamino)ethyl]carbamic acid CAS Name: [2-methyl-3-(1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)-1-oxo-1-(phenethylamino)propan-2-yl]carbamic acid IUPAC Name: [2-methyl-3-(1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)-1-oxo-1-(phenethylamino)propan-2-yl]carbamic acid Traditional Name: [2-keto-1-methyl-1-[(1-methyl-5-phenyl-2,3-dihydro-1,4-benzodiazepin-2-yl)methyl]-2-(phenethylamino)ethyl]carbamic acid Formula: C29H32N4O3 MolecularWeight: 484.58938

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1CN=C(C2=CC=CC=C2N1C)C3=CC=CC=C3)(C(=O)NCCC4=CC=CC=C4)NC(=O)O

Isomeric SMILES

CC(CC1CN=C(C2=CC=CC=C2N1C)C3=CC=CC=C3)(C(=O)NCCC4=CC=CC=C4)NC(=O)O

InChI

InChI=1S/C29H32N4O3/c1-29(32-28(35)36,27(34)30-18-17-21-11-5-3-6-12-21)19-23-20-31-26(22-13-7-4-8-14-22)24-15-9-10-16-25(24)33(23)2/h3-16,23,32H,17-20H2,1-2H3,(H,30,34)(H,35,36)