(2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[2-(4-methylphenyl)sulfanylethyl]butanamide

Systemtic Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[2-(4-methylphenyl)sulfanylethyl]butanamide Openeye Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[2-(p-tolylsulfanyl)ethyl]butanamide CAS Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[2-[(4-methylphenyl)thio]ethyl]butanamide IUPAC Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[2-(4-methylphenyl)sulfanylethyl]butanamide Traditional Name: (2S)-2-[(4-methoxyphenyl)sulfonylamino]-3-methyl-N-[2-(p-tolylthio)ethyl]butyramide Formula: C21H28N2O4S2 MolecularWeight: 436.58802

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCCNC(=O)C(C(C)C)NS(=O)(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CC1=CC=C(C=C1)SCCNC(=O)[C@H](C(C)C)NS(=O)(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C21H28N2O4S2/c1-15(2)20(23-29(25,26)19-11-7-17(27-4)8-12-19)21(24)22-13-14-28-18-9-5-16(3)6-10-18/h5-12,15,20,23H,13-14H2,1-4H3,(H,22,24)/t20-/m0/s1