2-chloranyl-N-[[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]pyridine-3-carboxamide

Systemtic Name: 2-chloranyl-N-[[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]pyridine-3-carboxamide Openeye Name: 2-chloro-N-[[1-(4-ethoxyphenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]pyridine-3-carboxamide CAS Name: 2-chloro-N-[[1-(4-ethoxyphenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-3-pyridinecarboxamide IUPAC Name: 2-chloro-N-[[1-(4-ethoxyphenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]pyridine-3-carboxamide Traditional Name: 2-chloro-N-[(2,5-dimethyl-1-p-phenetyl-pyrrol-3-yl)methyleneamino]nicotinamide Formula: C21H21ClN4O2 MolecularWeight: 396.87004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C(=CC(=C2C)C=NNC(=O)C3=C(N=CC=C3)Cl)C

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C(=CC(=C2C)C=NNC(=O)C3=C(N=CC=C3)Cl)C

InChI

InChI=1S/C21H21ClN4O2/c1-4-28-18-9-7-17(8-10-18)26-14(2)12-16(15(26)3)13-24-25-21(27)19-6-5-11-23-20(19)22/h5-13H,4H2,1-3H3,(H,25,27)