N-(2,6-dimethylphenyl)-2-[4-[3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanoyl]piperazin-1-yl]ethanamide

Systemtic Name: N-(2,6-dimethylphenyl)-2-[4-[3-(2-methyl-4-oxidanylidene-quinazolin-3-yl)propanoyl]piperazin-1-yl]ethanamide Openeye Name: N-(2,6-dimethylphenyl)-2-[4-[3-(2-methyl-4-oxo-quinazolin-3-yl)propanoyl]piperazin-1-yl]acetamide CAS Name: N-(2,6-dimethylphenyl)-2-[4-[3-(2-methyl-4-oxo-3-quinazolinyl)-1-oxopropyl]-1-piperazinyl]acetamide IUPAC Name: N-(2,6-dimethylphenyl)-2-[4-[3-(2-methyl-4-oxoquinazolin-3-yl)propanoyl]piperazin-1-yl]acetamide Traditional Name: N-(2,6-dimethylphenyl)-2-[4-[3-(4-keto-2-methyl-quinazolin-3-yl)propanoyl]piperazino]acetamide Formula: C26H31N5O3 MolecularWeight: 461.55604

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)CCN3C(=NC4=CC=CC=C4C3=O)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN2CCN(CC2)C(=O)CCN3C(=NC4=CC=CC=C4C3=O)C

InChI

InChI=1S/C26H31N5O3/c1-18-7-6-8-19(2)25(18)28-23(32)17-29-13-15-30(16-14-29)24(33)11-12-31-20(3)27-22-10-5-4-9-21(22)26(31)34/h4-10H,11-17H2,1-3H3,(H,28,32)