4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)butanamide

Systemtic Name: 4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)butanamide Openeye Name: 4-methylsulfanyl-N-(2-phenyl-2-pyrrolidin-1-yl-ethyl)-2-[[(E)-styryl]sulfonylamino]butanamide CAS Name: 4-(methylthio)-2-[[(E)-2-phenylethenyl]sulfonylamino]-N-[2-phenyl-2-(1-pyrrolidinyl)ethyl]butanamide IUPAC Name: 4-methylsulfanyl-2-[[(E)-2-phenylethenyl]sulfonylamino]-N-(2-phenyl-2-pyrrolidin-1-ylethyl)butanamide Traditional Name: 4-(methylthio)-N-(2-phenyl-2-pyrrolidino-ethyl)-2-[[(E)-styryl]sulfonylamino]butyramide Formula: C25H33N3O3S2 MolecularWeight: 487.67782

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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C(=O)NCC(C1=CC=CC=C1)N2CCCC2)NS(=O)(=O)C=CC3=CC=CC=C3

Isomeric SMILES

CSCCC(C(=O)NCC(C1=CC=CC=C1)N2CCCC2)NS(=O)(=O)/C=C/C3=CC=CC=C3

InChI

InChI=1S/C25H33N3O3S2/c1-32-18-14-23(27-33(30,31)19-15-21-10-4-2-5-11-21)25(29)26-20-24(28-16-8-9-17-28)22-12-6-3-7-13-22/h2-7,10-13,15,19,23-24,27H,8-9,14,16-18,20H2,1H3,(H,26,29)/b19-15+