1-[1-methyl-2-oxidanylidene-5-(2,4,6-trimethoxyphenyl)-3H-1,4-benzodiazepin-3-yl]-1-(2-methylphenyl)urea

Systemtic Name: 1-[1-methyl-2-oxidanylidene-5-(2,4,6-trimethoxyphenyl)-3H-1,4-benzodiazepin-3-yl]-1-(2-methylphenyl)urea Openeye Name: 1-[1-methyl-2-oxo-5-(2,4,6-trimethoxyphenyl)-3H-1,4-benzodiazepin-3-yl]-1-(o-tolyl)urea CAS Name: 1-[1-methyl-2-oxo-5-(2,4,6-trimethoxyphenyl)-3H-1,4-benzodiazepin-3-yl]-1-(2-methylphenyl)urea IUPAC Name: 1-[1-methyl-2-oxo-5-(2,4,6-trimethoxyphenyl)-3H-1,4-benzodiazepin-3-yl]-1-(2-methylphenyl)urea Traditional Name: 1-[2-keto-1-methyl-5-(2,4,6-trimethoxyphenyl)-3H-1,4-benzodiazepin-3-yl]-1-(o-tolyl)urea Formula: C27H28N4O5 MolecularWeight: 488.53502

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(C2C(=O)N(C3=CC=CC=C3C(=N2)C4=C(C=C(C=C4OC)OC)OC)C)C(=O)N

Isomeric SMILES

CC1=CC=CC=C1N(C2C(=O)N(C3=CC=CC=C3C(=N2)C4=C(C=C(C=C4OC)OC)OC)C)C(=O)N

InChI

InChI=1S/C27H28N4O5/c1-16-10-6-8-12-19(16)31(27(28)33)25-26(32)30(2)20-13-9-7-11-18(20)24(29-25)23-21(35-4)14-17(34-3)15-22(23)36-5/h6-15,25H,1-5H3,(H2,28,33)