5-chloranyl-2-[3-[[3-cyano-1-(phenylmethyl)pyrrolidin-3-yl]amino]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 5-chloranyl-2-[3-[[3-cyano-1-(phenylmethyl)pyrrolidin-3-yl]amino]-3-oxidanylidene-propyl]benzamide Openeye Name: 2-[3-[(1-benzyl-3-cyano-pyrrolidin-3-yl)amino]-3-oxo-propyl]-5-chloro-benzamide CAS Name: 5-chloro-2-[3-[[3-cyano-1-(phenylmethyl)-3-pyrrolidinyl]amino]-3-oxopropyl]benzamide IUPAC Name: 2-[3-[(1-benzyl-3-cyanopyrrolidin-3-yl)amino]-3-oxopropyl]-5-chlorobenzamide Traditional Name: 2-[3-[(1-benzyl-3-cyano-pyrrolidin-3-yl)amino]-3-keto-propyl]-5-chloro-benzamide Formula: C22H23ClN4O2 MolecularWeight: 410.89662

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC1(C#N)NC(=O)CCC2=C(C=C(C=C2)Cl)C(=O)N)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CC1(C#N)NC(=O)CCC2=C(C=C(C=C2)Cl)C(=O)N)CC3=CC=CC=C3

InChI

InChI=1S/C22H23ClN4O2/c23-18-8-6-17(19(12-18)21(25)29)7-9-20(28)26-22(14-24)10-11-27(15-22)13-16-4-2-1-3-5-16/h1-6,8,12H,7,9-11,13,15H2,(H2,25,29)(H,26,28)