N-[(5R)-2-tert-butyl-5-oxidanylidene-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4,5-triethoxy-benzamide

Systemtic Name: N-[(5R)-2-tert-butyl-5-oxidanylidene-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4,5-triethoxy-benzamide Openeye Name: N-[(5R)-2-tert-butyl-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4,5-triethoxy-benzamide CAS Name: N-[(5R)-2-tert-butyl-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4,5-triethoxybenzamide IUPAC Name: N-[(5R)-2-tert-butyl-5-oxo-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4,5-triethoxybenzamide Traditional Name: N-[(5R)-2-tert-butyl-5-keto-4,6-dihydrothieno[3,4-c]pyrazol-3-yl]-3,4,5-triethoxy-benzamide Formula: C22H31N3O5S MolecularWeight: 449.56364

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C3CS(=O)CC3=NN2C(C)(C)C

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)NC2=C3C[S@@](=O)CC3=NN2C(C)(C)C

InChI

InChI=1S/C22H31N3O5S/c1-7-28-17-10-14(11-18(29-8-2)19(17)30-9-3)21(26)23-20-15-12-31(27)13-16(15)24-25(20)22(4,5)6/h10-11H,7-9,12-13H2,1-6H3,(H,23,26)/t31-/m1/s1