5-cyano-N-[(3,4-dimethoxyphenyl)methyl]-2-(1-imidazol-1-ylpropan-2-ylamino)benzamide

Systemtic Name: 5-cyano-N-[(3,4-dimethoxyphenyl)methyl]-2-(1-imidazol-1-ylpropan-2-ylamino)benzamide Openeye Name: 5-cyano-N-[(3,4-dimethoxyphenyl)methyl]-2-[(2-imidazol-1-yl-1-methyl-ethyl)amino]benzamide CAS Name: 5-cyano-N-[(3,4-dimethoxyphenyl)methyl]-2-[1-(1-imidazolyl)propan-2-ylamino]benzamide IUPAC Name: 5-cyano-N-[(3,4-dimethoxyphenyl)methyl]-2-(1-imidazol-1-ylpropan-2-ylamino)benzamide Traditional Name: 5-cyano-2-[(2-imidazol-1-yl-1-methyl-ethyl)amino]-N-veratryl-benzamide Formula: C23H25N5O3 MolecularWeight: 419.4763

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C=CN=C1)NC2=C(C=C(C=C2)C#N)C(=O)NCC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CC(CN1C=CN=C1)NC2=C(C=C(C=C2)C#N)C(=O)NCC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C23H25N5O3/c1-16(14-28-9-8-25-15-28)27-20-6-4-17(12-24)10-19(20)23(29)26-13-18-5-7-21(30-2)22(11-18)31-3/h4-11,15-16,27H,13-14H2,1-3H3,(H,26,29)