ethyl 5-azanyl-1-(7-methylpyrimido[5,4-c]cinnolin-4-yl)-3-methylsulfanyl-pyrazole-4-carboxylate

Systemtic Name: ethyl 5-azanyl-1-(7-methylpyrimido[5,4-c]cinnolin-4-yl)-3-methylsulfanyl-pyrazole-4-carboxylate Openeye Name: ethyl 5-amino-1-(7-methylpyrimido[5,4-c]cinnolin-4-yl)-3-methylsulfanyl-pyrazole-4-carboxylate CAS Name: 5-amino-1-(7-methyl-4-pyrimido[5,4-c]cinnolinyl)-3-(methylthio)-4-pyrazolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-amino-1-(7-methylpyrimido[5,4-c]cinnolin-4-yl)-3-methylsulfanylpyrazole-4-carboxylate Traditional Name: 5-amino-1-(7-methylpyrimido[5,4-c]cinnolin-4-yl)-3-(methylthio)pyrazole-4-carboxylic acid ethyl ester Formula: C18H17N7O2S MolecularWeight: 395.43828

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(N=C1SC)C2=NC=NC3=C2N=NC4=C3C=CC=C4C)N

Isomeric SMILES

CCOC(=O)C1=C(N(N=C1SC)C2=NC=NC3=C2N=NC4=C3C=CC=C4C)N

InChI

InChI=1S/C18H17N7O2S/c1-4-27-18(26)11-15(19)25(24-17(11)28-3)16-14-13(20-8-21-16)10-7-5-6-9(2)12(10)22-23-14/h5-8H,4,19H2,1-3H3