ethyl 3-[[1-(5,6-dihydrobenzo[h]quinazolin-2-yl)-5-methyl-pyrazol-4-yl]carbonylamino]propanoate

Systemtic Name: ethyl 3-[[1-(5,6-dihydrobenzo[h]quinazolin-2-yl)-5-methyl-pyrazol-4-yl]carbonylamino]propanoate Openeye Name: ethyl 3-[[1-(5,6-dihydrobenzo[h]quinazolin-2-yl)-5-methyl-pyrazole-4-carbonyl]amino]propanoate CAS Name: 3-[[[1-(5,6-dihydrobenzo[h]quinazolin-2-yl)-5-methyl-4-pyrazolyl]-oxomethyl]amino]propanoic acid ethyl ester IUPAC Name: ethyl 3-[[1-(5,6-dihydrobenzo[h]quinazolin-2-yl)-5-methylpyrazole-4-carbonyl]amino]propanoate Traditional Name: 3-[[1-(5,6-dihydrobenzo[h]quinazolin-2-yl)-5-methyl-pyrazole-4-carbonyl]amino]propionic acid ethyl ester Formula: C22H23N5O3 MolecularWeight: 405.44972

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCNC(=O)C1=C(N(N=C1)C2=NC=C3CCC4=CC=CC=C4C3=N2)C

Isomeric SMILES

CCOC(=O)CCNC(=O)C1=C(N(N=C1)C2=NC=C3CCC4=CC=CC=C4C3=N2)C

InChI

InChI=1S/C22H23N5O3/c1-3-30-19(28)10-11-23-21(29)18-13-25-27(14(18)2)22-24-12-16-9-8-15-6-4-5-7-17(15)20(16)26-22/h4-7,12-13H,3,8-11H2,1-2H3,(H,23,29)