(5-ethoxycarbonyl-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl)methyl 5-bromanyl-1H-indole-3-carboxylate

Systemtic Name: (5-ethoxycarbonyl-4-methyl-2-oxidanylidene-3,4-dihydro-1H-pyrimidin-6-yl)methyl 5-bromanyl-1H-indole-3-carboxylate Openeye Name: (5-ethoxycarbonyl-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl 5-bromo-1H-indole-3-carboxylate CAS Name: 5-bromo-1H-indole-3-carboxylic acid (5-ethoxycarbonyl-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl ester IUPAC Name: (5-ethoxycarbonyl-4-methyl-2-oxo-3,4-dihydro-1H-pyrimidin-6-yl)methyl 5-bromo-1H-indole-3-carboxylate Traditional Name: 5-bromo-1H-indole-3-carboxylic acid (5-carbethoxy-2-keto-4-methyl-3,4-dihydro-1H-pyrimidin-6-yl)methyl ester Formula: C18H18BrN3O5 MolecularWeight: 436.25662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C2=CNC3=C2C=C(C=C3)Br

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)NC1C)COC(=O)C2=CNC3=C2C=C(C=C3)Br

InChI

InChI=1S/C18H18BrN3O5/c1-3-26-17(24)15-9(2)21-18(25)22-14(15)8-27-16(23)12-7-20-13-5-4-10(19)6-11(12)13/h4-7,9,20H,3,8H2,1-2H3,(H2,21,22,25)