ethyl 1,4,4-trimethyl-8-phenylazanyl-5H-pyrazolo[4,3-h]quinazoline-3-carboxylate

Systemtic Name: ethyl 1,4,4-trimethyl-8-phenylazanyl-5H-pyrazolo[4,3-h]quinazoline-3-carboxylate Openeye Name: ethyl 8-anilino-1,4,4-trimethyl-5H-pyrazolo[4,3-h]quinazoline-3-carboxylate CAS Name: 8-anilino-1,4,4-trimethyl-5H-pyrazolo[4,3-h]quinazoline-3-carboxylic acid ethyl ester IUPAC Name: ethyl 8-anilino-1,4,4-trimethyl-5H-pyrazolo[4,3-h]quinazoline-3-carboxylate Traditional Name: 8-anilino-1,4,4-trimethyl-5H-pyrazolo[4,3-h]quinazoline-3-carboxylic acid ethyl ester Formula: C21H23N5O2 MolecularWeight: 377.43962

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NN(C2=C1C(CC3=CN=C(N=C32)NC4=CC=CC=C4)(C)C)C

Isomeric SMILES

CCOC(=O)C1=NN(C2=C1C(CC3=CN=C(N=C32)NC4=CC=CC=C4)(C)C)C

InChI

InChI=1S/C21H23N5O2/c1-5-28-19(27)17-15-18(26(4)25-17)16-13(11-21(15,2)3)12-22-20(24-16)23-14-9-7-6-8-10-14/h6-10,12H,5,11H2,1-4H3,(H,22,23,24)