ethyl 5-methyl-5-(2-methylpyrazolo[1,5-a]pyrimidin-5-yl)-3-(4-pentylphenyl)carbonyl-2-sulfanylidene-1,3-oxazolidine-4-carboxylate

Systemtic Name: ethyl 5-methyl-5-(2-methylpyrazolo[1,5-a]pyrimidin-5-yl)-3-(4-pentylphenyl)carbonyl-2-sulfanylidene-1,3-oxazolidine-4-carboxylate Openeye Name: ethyl 5-methyl-5-(2-methylpyrazolo[1,5-a]pyrimidin-5-yl)-3-(4-pentylbenzoyl)-2-thioxo-oxazolidine-4-carboxylate CAS Name: 5-methyl-5-(2-methyl-5-pyrazolo[1,5-a]pyrimidinyl)-3-[oxo-(4-pentylphenyl)methyl]-2-sulfanylidene-4-oxazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 5-methyl-5-(2-methylpyrazolo[1,5-a]pyrimidin-5-yl)-3-(4-pentylbenzoyl)-2-sulfanylidene-1,3-oxazolidine-4-carboxylate Traditional Name: 3-(4-amylbenzoyl)-5-methyl-5-(2-methylpyrazolo[1,5-a]pyrimidin-5-yl)-2-thioxo-oxazolidine-4-carboxylic acid ethyl ester Formula: C26H30N4O4S MolecularWeight: 494.6058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)C(=O)N2C(C(OC2=S)(C)C3=NC4=CC(=NN4C=C3)C)C(=O)OCC

Isomeric SMILES

CCCCCC1=CC=C(C=C1)C(=O)N2C(C(OC2=S)(C)C3=NC4=CC(=NN4C=C3)C)C(=O)OCC

InChI

InChI=1S/C26H30N4O4S/c1-5-7-8-9-18-10-12-19(13-11-18)23(31)30-22(24(32)33-6-2)26(4,34-25(30)35)20-14-15-29-21(27-20)16-17(3)28-29/h10-16,22H,5-9H2,1-4H3