4-[[6-bromanyl-8-(2-methoxyethyl)-4-methyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]amino]-1-methyl-pyrrole-2-carboxylic acid

Systemtic Name: 4-[[6-bromanyl-8-(2-methoxyethyl)-4-methyl-7-oxidanylidene-pyrido[2,3-d]pyrimidin-2-yl]amino]-1-methyl-pyrrole-2-carboxylic acid Openeye Name: 4-[[6-bromo-8-(2-methoxyethyl)-4-methyl-7-oxo-pyrido[2,3-d]pyrimidin-2-yl]amino]-1-methyl-pyrrole-2-carboxylic acid CAS Name: 4-[[6-bromo-8-(2-methoxyethyl)-4-methyl-7-oxo-2-pyrido[2,3-d]pyrimidinyl]amino]-1-methyl-2-pyrrolecarboxylic acid IUPAC Name: 4-[[6-bromo-8-(2-methoxyethyl)-4-methyl-7-oxopyrido[2,3-d]pyrimidin-2-yl]amino]-1-methylpyrrole-2-carboxylic acid Traditional Name: 4-[[6-bromo-7-keto-8-(2-methoxyethyl)-4-methyl-pyrido[2,3-d]pyrimidin-2-yl]amino]-1-methyl-pyrrole-2-carboxylic acid Formula: C17H18BrN5O4 MolecularWeight: 436.25992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C=C(C(=O)N(C2=NC(=N1)NC3=CN(C(=C3)C(=O)O)C)CCOC)Br

Isomeric SMILES

CC1=C2C=C(C(=O)N(C2=NC(=N1)NC3=CN(C(=C3)C(=O)O)C)CCOC)Br

InChI

InChI=1S/C17H18BrN5O4/c1-9-11-7-12(18)15(24)23(4-5-27-3)14(11)21-17(19-9)20-10-6-13(16(25)26)22(2)8-10/h6-8H,4-5H2,1-3H3,(H,25,26)(H,19,20,21)