7-butylsulfanyl-9-oxidanylidene-N-(2H-1,2,3,4-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide

Systemtic Name: 7-butylsulfanyl-9-oxidanylidene-N-(2H-1,2,3,4-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide Openeye Name: 7-butylsulfanyl-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide CAS Name: 7-(butylthio)-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide IUPAC Name: 7-butylsulfanyl-9-oxo-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide Traditional Name: 7-(butylthio)-9-keto-N-(2H-tetrazol-5-yl)-1H-pyrazolo[5,1-b]quinazoline-2-carboxamide Formula: C16H16N8O2S MolecularWeight: 384.41564

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=CC2=C(C=C1)N=C3C=C(NN3C2=O)C(=O)NC4=NNN=N4

Isomeric SMILES

CCCCSC1=CC2=C(C=C1)N=C3C=C(NN3C2=O)C(=O)NC4=NNN=N4

InChI

InChI=1S/C16H16N8O2S/c1-2-3-6-27-9-4-5-11-10(7-9)15(26)24-13(17-11)8-12(21-24)14(25)18-16-19-22-23-20-16/h4-5,7-8,21H,2-3,6H2,1H3,(H2,18,19,20,22,23,25)