ethyl 5-azanyl-1-[5-[(4-bromophenyl)carbamoyl]pyridin-2-yl]pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-[5-[(4-bromophenyl)carbamoyl]pyridin-2-yl]pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-[5-[(4-bromophenyl)carbamoyl]-2-pyridyl]pyrazole-4-carboxylate CAS Name: 5-amino-1-[5-[(4-bromoanilino)-oxomethyl]-2-pyridinyl]-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-[5-[(4-bromophenyl)carbamoyl]pyridin-2-yl]pyrazole-4-carboxylate Traditional Name: 5-amino-1-[5-[(4-bromophenyl)carbamoyl]-2-pyridyl]pyrazole-4-carboxylic acid ethyl ester Formula: C18H16BrN5O3 MolecularWeight: 430.25534

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1)C2=NC=C(C=C2)C(=O)NC3=CC=C(C=C3)Br)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1)C2=NC=C(C=C2)C(=O)NC3=CC=C(C=C3)Br)N

InChI

InChI=1S/C18H16BrN5O3/c1-2-27-18(26)14-10-22-24(16(14)20)15-8-3-11(9-21-15)17(25)23-13-6-4-12(19)5-7-13/h3-10H,2,20H2,1H3,(H,23,25)