ethyl 4-[2-(1-methylindol-3-yl)-5-oxidanylidene-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl]butanoate

Systemtic Name: ethyl 4-[2-(1-methylindol-3-yl)-5-oxidanylidene-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl]butanoate Openeye Name: ethyl 4-[2-(1-methylindol-3-yl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl]butanoate CAS Name: 4-[2-(1-methyl-3-indolyl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl]butanoic acid ethyl ester IUPAC Name: ethyl 4-[2-(1-methylindol-3-yl)-5-oxo-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl]butanoate Traditional Name: 4-[5-keto-2-(1-methylindol-3-yl)-6,7-dihydropyrazolo[1,5-a]pyrimidin-4-yl]butyric acid ethyl ester Formula: C21H24N4O3 MolecularWeight: 380.44026

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCCN1C(=O)CCN2C1=CC(=N2)C3=CN(C4=CC=CC=C43)C

Isomeric SMILES

CCOC(=O)CCCN1C(=O)CCN2C1=CC(=N2)C3=CN(C4=CC=CC=C43)C

InChI

InChI=1S/C21H24N4O3/c1-3-28-21(27)9-6-11-24-19-13-17(22-25(19)12-10-20(24)26)16-14-23(2)18-8-5-4-7-15(16)18/h4-5,7-8,13-14H,3,6,9-12H2,1-2H3