2-(azepan-1-yl)-N-[(E)-[1-[3,5-bis(chloranyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-oxidanylidene-ethanamide

Systemtic Name: 2-(azepan-1-yl)-N-[(E)-[1-[3,5-bis(chloranyl)phenyl]-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-oxidanylidene-ethanamide Openeye Name: 2-(azepan-1-yl)-N-[(E)-[1-(3,5-dichlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-oxo-acetamide CAS Name: 2-(1-azepanyl)-N-[(E)-[1-(3,5-dichlorophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-2-oxoacetamide IUPAC Name: 2-(azepan-1-yl)-N-[(E)-[1-(3,5-dichlorophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-2-oxoacetamide Traditional Name: 2-(azepan-1-yl)-N-[(E)-[1-(3,5-dichlorophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-keto-acetamide Formula: C21H24Cl2N4O2 MolecularWeight: 435.34686

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC(=CC(=C2)Cl)Cl)C)C=NNC(=O)C(=O)N3CCCCCC3

Isomeric SMILES

CC1=CC(=C(N1C2=CC(=CC(=C2)Cl)Cl)C)/C=N/NC(=O)C(=O)N3CCCCCC3

InChI

InChI=1S/C21H24Cl2N4O2/c1-14-9-16(15(2)27(14)19-11-17(22)10-18(23)12-19)13-24-25-20(28)21(29)26-7-5-3-4-6-8-26/h9-13H,3-8H2,1-2H3,(H,25,28)/b24-13+