(4S,5R)-4-(4-butoxyphenyl)-6-methylidene-2-oxidanylidene-N-phenyl-1,3-diazinane-5-carboxamide

Systemtic Name: (4S,5R)-4-(4-butoxyphenyl)-6-methylidene-2-oxidanylidene-N-phenyl-1,3-diazinane-5-carboxamide Openeye Name: (4S,5R)-4-(4-butoxyphenyl)-6-methylene-2-oxo-N-phenyl-hexahydropyrimidine-5-carboxamide CAS Name: (4S,5R)-4-(4-butoxyphenyl)-6-methylene-2-oxo-N-phenyl-1,3-diazinane-5-carboxamide IUPAC Name: (4S,5R)-4-(4-butoxyphenyl)-6-methylidene-2-oxo-N-phenyl-1,3-diazinane-5-carboxamide Traditional Name: (4S,5R)-4-(4-butoxyphenyl)-2-keto-6-methylene-N-phenyl-hexahydropyrimidine-5-carboxamide Formula: C22H25N3O3 MolecularWeight: 379.4522

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C2C(C(=C)NC(=O)N2)C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=C(C=C1)[C@@H]2[C@H](C(=C)NC(=O)N2)C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O3/c1-3-4-14-28-18-12-10-16(11-13-18)20-19(15(2)23-22(27)25-20)21(26)24-17-8-6-5-7-9-17/h5-13,19-20H,2-4,14H2,1H3,(H,24,26)(H2,23,25,27)/t19-,20+/m0/s1