2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-[(2,3,4-trimethoxyphenyl)methyl]butanamide

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-[(2,3,4-trimethoxyphenyl)methyl]butanamide Openeye Name: 4-methylsulfanyl-2-(p-tolylsulfonylamino)-N-[(2,3,4-trimethoxyphenyl)methyl]butanamide CAS Name: 2-[(4-methylphenyl)sulfonylamino]-4-(methylthio)-N-[(2,3,4-trimethoxyphenyl)methyl]butanamide IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-4-methylsulfanyl-N-[(2,3,4-trimethoxyphenyl)methyl]butanamide Traditional Name: 4-(methylthio)-2-(tosylamino)-N-(2,3,4-trimethoxybenzyl)butyramide Formula: C22H30N2O6S2 MolecularWeight: 482.6134

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCC2=C(C(=C(C=C2)OC)OC)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCSC)C(=O)NCC2=C(C(=C(C=C2)OC)OC)OC

InChI

InChI=1S/C22H30N2O6S2/c1-15-6-9-17(10-7-15)32(26,27)24-18(12-13-31-5)22(25)23-14-16-8-11-19(28-2)21(30-4)20(16)29-3/h6-11,18,24H,12-14H2,1-5H3,(H,23,25)