N-(3-cyanophenyl)-2-[2-methoxyethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanamide

Systemtic Name: N-(3-cyanophenyl)-2-[2-methoxyethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanamide Openeye Name: N-(3-cyanophenyl)-2-[2-methoxyethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetamide CAS Name: N-(3-cyanophenyl)-2-[2-methoxyethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetamide IUPAC Name: N-(3-cyanophenyl)-2-[2-methoxyethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetamide Traditional Name: N-(3-cyanophenyl)-2-[(4-keto-1H-quinazolin-2-yl)methyl-(2-methoxyethyl)amino]acetamide Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C21H21N5O3/c1-29-10-9-26(14-20(27)23-16-6-4-5-15(11-16)12-22)13-19-24-18-8-3-2-7-17(18)21(28)25-19/h2-8,11H,9-10,13-14H2,1H3,(H,23,27)(H,24,25,28)