2-[2-(3-aminophenyl)-1-methyl-4-oxidanylidene-5-(propan-2-ylamino)pyridin-3-yl]-N-[(4-ethanimidoylphenyl)methyl]ethanamide

Systemtic Name: 2-[2-(3-aminophenyl)-1-methyl-4-oxidanylidene-5-(propan-2-ylamino)pyridin-3-yl]-N-[(4-ethanimidoylphenyl)methyl]ethanamide Openeye Name: 2-[2-(3-aminophenyl)-5-(isopropylamino)-1-methyl-4-oxo-3-pyridyl]-N-[(4-ethanimidoylphenyl)methyl]acetamide CAS Name: 2-[2-(3-aminophenyl)-1-methyl-4-oxo-5-(propan-2-ylamino)-3-pyridinyl]-N-[[4-(1-iminoethyl)phenyl]methyl]acetamide IUPAC Name: 2-[2-(3-aminophenyl)-1-methyl-4-oxo-5-(propan-2-ylamino)pyridin-3-yl]-N-[(4-ethanimidoylphenyl)methyl]acetamide Traditional Name: N-(4-acetimidoylbenzyl)-2-[2-(3-aminophenyl)-5-(isopropylamino)-4-keto-1-methyl-3-pyridyl]acetamide Formula: C26H31N5O2 MolecularWeight: 445.55664

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC1=CN(C(=C(C1=O)CC(=O)NCC2=CC=C(C=C2)C(=N)C)C3=CC(=CC=C3)N)C

Isomeric SMILES

CC(C)NC1=CN(C(=C(C1=O)CC(=O)NCC2=CC=C(C=C2)C(=N)C)C3=CC(=CC=C3)N)C

InChI

InChI=1S/C26H31N5O2/c1-16(2)30-23-15-31(4)25(20-6-5-7-21(28)12-20)22(26(23)33)13-24(32)29-14-18-8-10-19(11-9-18)17(3)27/h5-12,15-16,27,30H,13-14,28H2,1-4H3,(H,29,32)