2-cyano-N-(3,4-dichlorophenyl)-3-(3-methyl-4-pyrrolidin-1-yl-phenyl)prop-2-enamide

Systemtic Name: 2-cyano-N-(3,4-dichlorophenyl)-3-(3-methyl-4-pyrrolidin-1-yl-phenyl)prop-2-enamide Openeye Name: 2-cyano-N-(3,4-dichlorophenyl)-3-(3-methyl-4-pyrrolidin-1-yl-phenyl)prop-2-enamide CAS Name: 2-cyano-N-(3,4-dichlorophenyl)-3-[3-methyl-4-(1-pyrrolidinyl)phenyl]-2-propenamide IUPAC Name: 2-cyano-N-(3,4-dichlorophenyl)-3-(3-methyl-4-pyrrolidin-1-ylphenyl)prop-2-enamide Traditional Name: 2-cyano-N-(3,4-dichlorophenyl)-3-(3-methyl-4-pyrrolidino-phenyl)acrylamide Formula: C21H19Cl2N3O MolecularWeight: 400.30106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC(=C(C=C2)Cl)Cl)N3CCCC3

Isomeric SMILES

CC1=C(C=CC(=C1)C=C(C#N)C(=O)NC2=CC(=C(C=C2)Cl)Cl)N3CCCC3

InChI

InChI=1S/C21H19Cl2N3O/c1-14-10-15(4-7-20(14)26-8-2-3-9-26)11-16(13-24)21(27)25-17-5-6-18(22)19(23)12-17/h4-7,10-12H,2-3,8-9H2,1H3,(H,25,27)