N-(1,3-benzodioxol-5-ylmethyl)-6-chloranyl-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-6-chloranyl-5-methyl-7-oxidanylidene-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-6-chloro-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-6-chloro-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-6-chloro-5-methyl-7-oxo-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide Traditional Name: 6-chloro-7-keto-5-methyl-N-piperonyl-1H-pyrazolo[1,5-a]pyrimidine-3-carboxamide Formula: C16H13ClN4O4 MolecularWeight: 360.75182

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)N2C(=N1)C(=CN2)C(=O)NCC3=CC4=C(C=C3)OCO4)Cl

Isomeric SMILES

CC1=C(C(=O)N2C(=N1)C(=CN2)C(=O)NCC3=CC4=C(C=C3)OCO4)Cl

InChI

InChI=1S/C16H13ClN4O4/c1-8-13(17)16(23)21-14(20-8)10(6-19-21)15(22)18-5-9-2-3-11-12(4-9)25-7-24-11/h2-4,6,19H,5,7H2,1H3,(H,18,22)