5-ethyl-2-[(4-methylphenyl)amino]-3-(4-methylphenyl)sulfonyl-1H-pyrazolo[1,5-a]pyrimidin-7-one

Systemtic Name: 5-ethyl-2-[(4-methylphenyl)amino]-3-(4-methylphenyl)sulfonyl-1H-pyrazolo[1,5-a]pyrimidin-7-one Openeye Name: 5-ethyl-2-(4-methylanilino)-3-(p-tolylsulfonyl)-1H-pyrazolo[1,5-a]pyrimidin-7-one CAS Name: 5-ethyl-2-(4-methylanilino)-3-(4-methylphenyl)sulfonyl-1H-pyrazolo[1,5-a]pyrimidin-7-one IUPAC Name: 5-ethyl-2-(4-methylanilino)-3-(4-methylphenyl)sulfonyl-1H-pyrazolo[1,5-a]pyrimidin-7-one Traditional Name: 5-ethyl-2-(p-toluidino)-3-tosyl-1H-pyrazolo[1,5-a]pyrimidin-7-one Formula: C22H22N4O3S MolecularWeight: 422.50008

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=O)N2C(=N1)C(=C(N2)NC3=CC=C(C=C3)C)S(=O)(=O)C4=CC=C(C=C4)C

Isomeric SMILES

CCC1=CC(=O)N2C(=N1)C(=C(N2)NC3=CC=C(C=C3)C)S(=O)(=O)C4=CC=C(C=C4)C

InChI

InChI=1S/C22H22N4O3S/c1-4-16-13-19(27)26-22(24-16)20(30(28,29)18-11-7-15(3)8-12-18)21(25-26)23-17-9-5-14(2)6-10-17/h5-13,23,25H,4H2,1-3H3