1-(4-bromanyl-3-methyl-phenyl)-3-[1-(3,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]urea

Systemtic Name: 1-(4-bromanyl-3-methyl-phenyl)-3-[1-(3,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]urea Openeye Name: 1-(4-bromo-3-methyl-phenyl)-3-[1-(3,4-dimethoxyphenyl)-5-oxo-pyrrolidin-3-yl]urea CAS Name: 1-(4-bromo-3-methylphenyl)-3-[1-(3,4-dimethoxyphenyl)-5-oxo-3-pyrrolidinyl]urea IUPAC Name: 1-(4-bromo-3-methylphenyl)-3-[1-(3,4-dimethoxyphenyl)-5-oxopyrrolidin-3-yl]urea Traditional Name: 1-(4-bromo-3-methyl-phenyl)-3-[1-(3,4-dimethoxyphenyl)-5-keto-pyrrolidin-3-yl]urea Formula: C20H22BrN3O4 MolecularWeight: 448.31038

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)NC2CC(=O)N(C2)C3=CC(=C(C=C3)OC)OC)Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)NC2CC(=O)N(C2)C3=CC(=C(C=C3)OC)OC)Br

InChI

InChI=1S/C20H22BrN3O4/c1-12-8-13(4-6-16(12)21)22-20(26)23-14-9-19(25)24(11-14)15-5-7-17(27-2)18(10-15)28-3/h4-8,10,14H,9,11H2,1-3H3,(H2,22,23,26)