N-[2-butyl-3-[(6-chloranyl-2-cyano-3-phenyl-phenyl)methyl]-4H-benzimidazol-5-ylidene]-3-ethyl-3-methyl-5-oxidanylidene-pentanamide

Systemtic Name: N-[2-butyl-3-[(6-chloranyl-2-cyano-3-phenyl-phenyl)methyl]-4H-benzimidazol-5-ylidene]-3-ethyl-3-methyl-5-oxidanylidene-pentanamide Openeye Name: N-[2-butyl-3-[(6-chloro-2-cyano-3-phenyl-phenyl)methyl]-4H-benzimidazol-5-ylidene]-3-ethyl-3-methyl-5-oxo-pentanamide CAS Name: N-[2-butyl-3-[(6-chloro-2-cyano-3-phenylphenyl)methyl]-4H-benzimidazol-5-ylidene]-3-ethyl-3-methyl-5-oxopentanamide IUPAC Name: N-[2-butyl-3-[(6-chloro-2-cyano-3-phenylphenyl)methyl]-4H-benzimidazol-5-ylidene]-3-ethyl-3-methyl-5-oxopentanamide Traditional Name: N-[2-butyl-3-(6-chloro-2-cyano-3-phenyl-benzyl)-4H-benzimidazol-5-ylidene]-3-ethyl-5-keto-3-methyl-valeramide Formula: C33H35ClN4O2 MolecularWeight: 555.1096

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=NC2=C(N1CC3=C(C=CC(=C3C#N)C4=CC=CC=C4)Cl)CC(=NC(=O)CC(C)(CC)CC=O)C=C2

Isomeric SMILES

CCCCC1=NC2=C(N1CC3=C(C=CC(=C3C#N)C4=CC=CC=C4)Cl)CC(=NC(=O)CC(C)(CC)CC=O)C=C2

InChI

InChI=1S/C33H35ClN4O2/c1-4-6-12-31-37-29-16-13-24(36-32(40)20-33(3,5-2)17-18-39)19-30(29)38(31)22-27-26(21-35)25(14-15-28(27)34)23-10-8-7-9-11-23/h7-11,13-16,18H,4-6,12,17,19-20,22H2,1-3H3