(1S,2S)-N-[2-(4-methoxyphenyl)ethyl]-2-(4-oxidanylidene-1H-quinazolin-2-yl)cyclohexane-1-carboxamide

Systemtic Name: (1S,2S)-N-[2-(4-methoxyphenyl)ethyl]-2-(4-oxidanylidene-1H-quinazolin-2-yl)cyclohexane-1-carboxamide Openeye Name: (1S,2S)-N-[2-(4-methoxyphenyl)ethyl]-2-(4-oxo-1H-quinazolin-2-yl)cyclohexanecarboxamide CAS Name: (1S,2S)-N-[2-(4-methoxyphenyl)ethyl]-2-(4-oxo-1H-quinazolin-2-yl)-1-cyclohexanecarboxamide IUPAC Name: (1S,2S)-N-[2-(4-methoxyphenyl)ethyl]-2-(4-oxo-1H-quinazolin-2-yl)cyclohexane-1-carboxamide Traditional Name: (1S,2S)-2-(4-keto-1H-quinazolin-2-yl)-N-[2-(4-methoxyphenyl)ethyl]cyclohexanecarboxamide Formula: C24H27N3O3 MolecularWeight: 405.48948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=O)C2CCCCC2C3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=O)[C@H]2CCCC[C@@H]2C3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C24H27N3O3/c1-30-17-12-10-16(11-13-17)14-15-25-23(28)19-7-3-2-6-18(19)22-26-21-9-5-4-8-20(21)24(29)27-22/h4-5,8-13,18-19H,2-3,6-7,14-15H2,1H3,(H,25,28)(H,26,27,29)/t18-,19-/m0/s1