6-methyl-2-oxidanylidene-4-[4-(2-pyrrolo[2,3-b]pyridin-1-ylethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid

Systemtic Name: 6-methyl-2-oxidanylidene-4-[4-(2-pyrrolo[2,3-b]pyridin-1-ylethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid Openeye Name: 6-methyl-2-oxo-4-[4-(2-pyrrolo[2,3-b]pyridin-1-ylethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid CAS Name: 6-methyl-2-oxo-4-[4-[2-(1-pyrrolo[2,3-b]pyridinyl)ethoxy]phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid IUPAC Name: 6-methyl-2-oxo-4-[4-(2-pyrrolo[2,3-b]pyridin-1-ylethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid Traditional Name: 2-keto-6-methyl-4-[4-(2-pyrrolo[2,3-b]pyridin-1-ylethoxy)phenyl]-3,4-dihydro-1H-pyrimidine-5-carboxylic acid Formula: C21H20N4O4 MolecularWeight: 392.4079

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(NC(=O)N1)C2=CC=C(C=C2)OCCN3C=CC4=C3N=CC=C4)C(=O)O

Isomeric SMILES

CC1=C(C(NC(=O)N1)C2=CC=C(C=C2)OCCN3C=CC4=C3N=CC=C4)C(=O)O

InChI

InChI=1S/C21H20N4O4/c1-13-17(20(26)27)18(24-21(28)23-13)14-4-6-16(7-5-14)29-12-11-25-10-8-15-3-2-9-22-19(15)25/h2-10,18H,11-12H2,1H3,(H,26,27)(H2,23,24,28)