N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide

Systemtic Name: N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Openeye Name: 4-methylsulfanyl-N-[2-(p-tolylmethylsulfanyl)ethyl]-2-[[(E)-styryl]sulfonylamino]butanamide CAS Name: N-[2-[(4-methylphenyl)methylthio]ethyl]-4-(methylthio)-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide IUPAC Name: N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Traditional Name: N-[2-[(4-methylbenzyl)thio]ethyl]-4-(methylthio)-2-[[(E)-styryl]sulfonylamino]butyramide Formula: C23H30N2O3S3 MolecularWeight: 478.6909

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)C(CCSC)NS(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)C(CCSC)NS(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C23H30N2O3S3/c1-19-8-10-21(11-9-19)18-30-16-14-24-23(26)22(12-15-29-2)25-31(27,28)17-13-20-6-4-3-5-7-20/h3-11,13,17,22,25H,12,14-16,18H2,1-2H3,(H,24,26)/b17-13+