1-(2-chlorophenyl)-1-[5-(2,6-dimethoxy-4-methyl-phenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]urea

Systemtic Name: 1-(2-chlorophenyl)-1-[5-(2,6-dimethoxy-4-methyl-phenyl)-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl]urea Openeye Name: 1-(2-chlorophenyl)-1-[5-(2,6-dimethoxy-4-methyl-phenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]urea CAS Name: 1-(2-chlorophenyl)-1-[5-(2,6-dimethoxy-4-methylphenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]urea IUPAC Name: 1-(2-chlorophenyl)-1-[5-(2,6-dimethoxy-4-methylphenyl)-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl]urea Traditional Name: 1-(2-chlorophenyl)-1-[5-(2,6-dimethoxy-4-methyl-phenyl)-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl]urea Formula: C26H25ClN4O4 MolecularWeight: 492.9541

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC)C2=NC(C(=O)N(C3=CC=CC=C32)C)N(C4=CC=CC=C4Cl)C(=O)N)OC

Isomeric SMILES

CC1=CC(=C(C(=C1)OC)C2=NC(C(=O)N(C3=CC=CC=C32)C)N(C4=CC=CC=C4Cl)C(=O)N)OC

InChI

InChI=1S/C26H25ClN4O4/c1-15-13-20(34-3)22(21(14-15)35-4)23-16-9-5-7-11-18(16)30(2)25(32)24(29-23)31(26(28)33)19-12-8-6-10-17(19)27/h5-14,24H,1-4H3,(H2,28,33)