2-[3-azanyl-4-(2,4-dichlorophenyl)sulfanyl-phenyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]prop-2-enamide

Systemtic Name: 2-[3-azanyl-4-(2,4-dichlorophenyl)sulfanyl-phenyl]-N-[3-(2-oxidanylidenepyrrolidin-1-yl)propyl]prop-2-enamide Openeye Name: 2-[3-amino-4-(2,4-dichlorophenyl)sulfanyl-phenyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]prop-2-enamide CAS Name: 2-[3-amino-4-[(2,4-dichlorophenyl)thio]phenyl]-N-[3-(2-oxo-1-pyrrolidinyl)propyl]-2-propenamide IUPAC Name: 2-[3-amino-4-(2,4-dichlorophenyl)sulfanylphenyl]-N-[3-(2-oxopyrrolidin-1-yl)propyl]prop-2-enamide Traditional Name: 2-[3-amino-4-[(2,4-dichlorophenyl)thio]phenyl]-N-[3-(2-ketopyrrolidino)propyl]acrylamide Formula: C22H23Cl2N3O2S MolecularWeight: 464.40792

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Descriptors Computed from Structure

Canonical SMILES:

C=C(C1=CC(=C(C=C1)SC2=C(C=C(C=C2)Cl)Cl)N)C(=O)NCCCN3CCCC3=O

Isomeric SMILES

C=C(C1=CC(=C(C=C1)SC2=C(C=C(C=C2)Cl)Cl)N)C(=O)NCCCN3CCCC3=O

InChI

InChI=1S/C22H23Cl2N3O2S/c1-14(22(29)26-9-3-11-27-10-2-4-21(27)28)15-5-7-20(18(25)12-15)30-19-8-6-16(23)13-17(19)24/h5-8,12-13H,1-4,9-11,25H2,(H,26,29)