N-butyl-N-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3,5,5-trimethyl-hexanamide

Systemtic Name: N-butyl-N-[1-[3-(4-ethoxyphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]-3,5,5-trimethyl-hexanamide Openeye Name: N-butyl-N-[1-[3-(4-ethoxyphenyl)-4-oxo-quinazolin-2-yl]ethyl]-3,5,5-trimethyl-hexanamide CAS Name: N-butyl-N-[1-[3-(4-ethoxyphenyl)-4-oxo-2-quinazolinyl]ethyl]-3,5,5-trimethylhexanamide IUPAC Name: N-butyl-N-[1-[3-(4-ethoxyphenyl)-4-oxoquinazolin-2-yl]ethyl]-3,5,5-trimethylhexanamide Traditional Name: N-butyl-N-[1-(4-keto-3-p-phenetyl-quinazolin-2-yl)ethyl]-3,5,5-trimethyl-hexanamide Formula: C31H43N3O3 MolecularWeight: 505.69142

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OCC)C(=O)CC(C)CC(C)(C)C

Isomeric SMILES

CCCCN(C(C)C1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)OCC)C(=O)CC(C)CC(C)(C)C

InChI

InChI=1S/C31H43N3O3/c1-8-10-19-33(28(35)20-22(3)21-31(5,6)7)23(4)29-32-27-14-12-11-13-26(27)30(36)34(29)24-15-17-25(18-16-24)37-9-2/h11-18,22-23H,8-10,19-21H2,1-7H3