N-[(S)-(4-methoxyphenyl)-phenyl-methyl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-[(S)-(4-methoxyphenyl)-phenyl-methyl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-[(S)-(4-methoxyphenyl)-phenyl-methyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[(S)-(4-methoxyphenyl)-phenylmethyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-[(S)-(4-methoxyphenyl)-phenylmethyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)-N-[(S)-(4-methoxyphenyl)-phenyl-methyl]propionamide Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(C2=CC=CC=C2)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](C2=CC=CC=C2)NC(=O)CCC3=NC(=O)C4=CC=CC=C4N3

InChI

InChI=1S/C25H23N3O3/c1-31-19-13-11-18(12-14-19)24(17-7-3-2-4-8-17)28-23(29)16-15-22-26-21-10-6-5-9-20(21)25(30)27-22/h2-14,24H,15-16H2,1H3,(H,28,29)(H,26,27,30)/t24-/m0/s1