N-(4-bromanyl-3-methyl-phenyl)-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide

Systemtic Name: N-(4-bromanyl-3-methyl-phenyl)-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Openeye Name: N-(4-bromo-3-methyl-phenyl)-4-methylsulfanyl-2-[[(E)-styryl]sulfonylamino]butanamide CAS Name: N-(4-bromo-3-methylphenyl)-4-(methylthio)-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide IUPAC Name: N-(4-bromo-3-methylphenyl)-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Traditional Name: N-(4-bromo-3-methyl-phenyl)-4-(methylthio)-2-[[(E)-styryl]sulfonylamino]butyramide Formula: C20H23BrN2O3S2 MolecularWeight: 483.44222

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H23BrN2O3S2/c1-15-14-17(8-9-18(15)21)22-20(24)19(10-12-27-2)23-28(25,26)13-11-16-6-4-3-5-7-16/h3-9,11,13-14,19,23H,10,12H2,1-2H3,(H,22,24)/b13-11+