2-[(4-methylphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(pyridin-2-ylmethyl)ethanamide

Systemtic Name: 2-[(4-methylphenyl)-(4-methylsulfanylphenyl)sulfonyl-amino]-N-(pyridin-2-ylmethyl)ethanamide Openeye Name: 2-(4-methyl-N-(4-methylsulfanylphenyl)sulfonyl-anilino)-N-(2-pyridylmethyl)acetamide CAS Name: 2-(4-methyl-N-[4-(methylthio)phenyl]sulfonylanilino)-N-(2-pyridinylmethyl)acetamide IUPAC Name: 2-(4-methyl-N-(4-methylsulfanylphenyl)sulfonylanilino)-N-(pyridin-2-ylmethyl)acetamide Traditional Name: 2-(4-methyl-N-[4-(methylthio)phenyl]sulfonyl-anilino)-N-(2-pyridylmethyl)acetamide Formula: C22H23N3O3S2 MolecularWeight: 441.56632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC(=O)NCC2=CC=CC=N2)S(=O)(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC1=CC=C(C=C1)N(CC(=O)NCC2=CC=CC=N2)S(=O)(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C22H23N3O3S2/c1-17-6-8-19(9-7-17)25(16-22(26)24-15-18-5-3-4-14-23-18)30(27,28)21-12-10-20(29-2)11-13-21/h3-14H,15-16H2,1-2H3,(H,24,26)