N-[4-(azepan-1-yl)phenyl]-2-[ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-2-[ethyl-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]amino]ethanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-2-[ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetamide CAS Name: N-[4-(1-azepanyl)phenyl]-2-[ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-2-[ethyl-[(4-oxo-1H-quinazolin-2-yl)methyl]amino]acetamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-2-[ethyl-[(4-keto-1H-quinazolin-2-yl)methyl]amino]acetamide Formula: C25H31N5O2 MolecularWeight: 433.54594

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=CC=C(C=C3)N4CCCCCC4

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC=CC=C2N1)CC(=O)NC3=CC=C(C=C3)N4CCCCCC4

InChI

InChI=1S/C25H31N5O2/c1-2-29(17-23-27-22-10-6-5-9-21(22)25(32)28-23)18-24(31)26-19-11-13-20(14-12-19)30-15-7-3-4-8-16-30/h5-6,9-14H,2-4,7-8,15-18H2,1H3,(H,26,31)(H,27,28,32)