N-[(4-dimethylaminophenyl)methyl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide

Systemtic Name: N-[(4-dimethylaminophenyl)methyl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Openeye Name: N-[(4-dimethylaminophenyl)methyl]-4-methylsulfanyl-2-[[(E)-styryl]sulfonylamino]butanamide CAS Name: N-[(4-dimethylaminophenyl)methyl]-4-(methylthio)-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide IUPAC Name: N-[(4-dimethylaminophenyl)methyl]-4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]butanamide Traditional Name: N-[4-(dimethylamino)benzyl]-4-(methylthio)-2-[[(E)-styryl]sulfonylamino]butyramide Formula: C22H29N3O3S2 MolecularWeight: 447.61396

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CNC(=O)C(CCSC)NS(=O)(=O)C=CC2=CC=CC=C2

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CNC(=O)C(CCSC)NS(=O)(=O)/C=C/C2=CC=CC=C2

InChI

InChI=1S/C22H29N3O3S2/c1-25(2)20-11-9-19(10-12-20)17-23-22(26)21(13-15-29-3)24-30(27,28)16-14-18-7-5-4-6-8-18/h4-12,14,16,21,24H,13,15,17H2,1-3H3,(H,23,26)/b16-14+