butyl N-[4-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)thiophen-2-yl]sulfonylcarbamate

Systemtic Name: butyl N-[4-(1-methyl-7-oxidanylidene-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)thiophen-2-yl]sulfonylcarbamate Openeye Name: butyl N-[[4-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-2-thienyl]sulfonyl]carbamate CAS Name: N-[[4-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-2-thiophenyl]sulfonyl]carbamic acid butyl ester IUPAC Name: butyl N-[4-(1-methyl-7-oxo-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)thiophen-2-yl]sulfonylcarbamate Traditional Name: N-[[4-(7-keto-1-methyl-3-propyl-4H-pyrazolo[4,3-d]pyrimidin-5-yl)-2-thienyl]sulfonyl]carbamic acid butyl ester Formula: C18H23N5O5S2 MolecularWeight: 453.53572

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)NS(=O)(=O)C1=CC(=CS1)C2=NC(=O)C3=C(N2)C(=NN3C)CCC

Isomeric SMILES

CCCCOC(=O)NS(=O)(=O)C1=CC(=CS1)C2=NC(=O)C3=C(N2)C(=NN3C)CCC

InChI

InChI=1S/C18H23N5O5S2/c1-4-6-8-28-18(25)22-30(26,27)13-9-11(10-29-13)16-19-14-12(7-5-2)21-23(3)15(14)17(24)20-16/h9-10H,4-8H2,1-3H3,(H,22,25)(H,19,20,24)