2-chloranyl-4-[(2-chlorophenyl)methyl-[(3S)-5-oxidanylidene-1-propan-2-yl-pyrrolidin-3-yl]amino]benzenecarbonitrile

Systemtic Name: 2-chloranyl-4-[(2-chlorophenyl)methyl-[(3S)-5-oxidanylidene-1-propan-2-yl-pyrrolidin-3-yl]amino]benzenecarbonitrile Openeye Name: 2-chloro-4-[(2-chlorophenyl)methyl-[(3S)-1-isopropyl-5-oxo-pyrrolidin-3-yl]amino]benzonitrile CAS Name: 2-chloro-4-[(2-chlorophenyl)methyl-[(3S)-5-oxo-1-propan-2-yl-3-pyrrolidinyl]amino]benzonitrile IUPAC Name: 2-chloro-4-[(2-chlorophenyl)methyl-[(3S)-5-oxo-1-propan-2-ylpyrrolidin-3-yl]amino]benzonitrile Traditional Name: 2-chloro-4-[(2-chlorobenzyl)-[(3S)-1-isopropyl-5-keto-pyrrolidin-3-yl]amino]benzonitrile Formula: C21H21Cl2N3O MolecularWeight: 402.31694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1CC(CC1=O)N(CC2=CC=CC=C2Cl)C3=CC(=C(C=C3)C#N)Cl

Isomeric SMILES

CC(C)N1C[C@H](CC1=O)N(CC2=CC=CC=C2Cl)C3=CC(=C(C=C3)C#N)Cl

InChI

InChI=1S/C21H21Cl2N3O/c1-14(2)25-13-18(10-21(25)27)26(12-16-5-3-4-6-19(16)22)17-8-7-15(11-24)20(23)9-17/h3-9,14,18H,10,12-13H2,1-2H3/t18-/m0/s1