(4S,5S)-4-(4-butoxyphenyl)-6-methylidene-5-(phenylcarbonyl)-1,3-diazinan-2-one

Systemtic Name: (4S,5S)-4-(4-butoxyphenyl)-6-methylidene-5-(phenylcarbonyl)-1,3-diazinan-2-one Openeye Name: (4S,5S)-5-benzoyl-4-(4-butoxyphenyl)-6-methylene-hexahydropyrimidin-2-one CAS Name: (4S,5S)-5-benzoyl-4-(4-butoxyphenyl)-6-methylene-1,3-diazinan-2-one IUPAC Name: (4S,5S)-5-benzoyl-4-(4-butoxyphenyl)-6-methylidene-1,3-diazinan-2-one Traditional Name: (4S,5S)-5-benzoyl-4-(4-butoxyphenyl)-6-methylene-hexahydropyrimidin-2-one Formula: C22H24N2O3 MolecularWeight: 364.43756

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(C(=C)NC(=O)N2)C(=O)C3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)[C@@H]2[C@@H](C(=C)NC(=O)N2)C(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H24N2O3/c1-3-4-14-27-18-12-10-16(11-13-18)20-19(15(2)23-22(26)24-20)21(25)17-8-6-5-7-9-17/h5-13,19-20H,2-4,14H2,1H3,(H2,23,24,26)/t19-,20-/m1/s1