2-[5-azanyl-3-ethylsulfanyl-4-(phenylsulfonyl)pyrazol-1-yl]-N-(4-methoxyphenyl)ethanamide

Systemtic Name: 2-[5-azanyl-3-ethylsulfanyl-4-(phenylsulfonyl)pyrazol-1-yl]-N-(4-methoxyphenyl)ethanamide Openeye Name: 2-[5-amino-4-(benzenesulfonyl)-3-ethylsulfanyl-pyrazol-1-yl]-N-(4-methoxyphenyl)acetamide CAS Name: 2-[5-amino-4-(benzenesulfonyl)-3-(ethylthio)-1-pyrazolyl]-N-(4-methoxyphenyl)acetamide IUPAC Name: 2-[5-amino-4-(benzenesulfonyl)-3-ethylsulfanylpyrazol-1-yl]-N-(4-methoxyphenyl)acetamide Traditional Name: 2-[5-amino-4-besyl-3-(ethylthio)pyrazol-1-yl]-N-(4-methoxyphenyl)acetamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN(C(=C1S(=O)(=O)C2=CC=CC=C2)N)CC(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CCSC1=NN(C(=C1S(=O)(=O)C2=CC=CC=C2)N)CC(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H22N4O4S2/c1-3-29-20-18(30(26,27)16-7-5-4-6-8-16)19(21)24(23-20)13-17(25)22-14-9-11-15(28-2)12-10-14/h4-12H,3,13,21H2,1-2H3,(H,22,25)