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

Systemtic Name: (4S,5R)-4-(5-bromanyl-2-propoxy-phenyl)-N-(2-methoxyphenyl)-6-methylidene-2-oxidanylidene-1,3-diazinane-5-carboxamide Openeye Name: (4S,5R)-4-(5-bromo-2-propoxy-phenyl)-N-(2-methoxyphenyl)-6-methylene-2-oxo-hexahydropyrimidine-5-carboxamide CAS Name: (4S,5R)-4-(5-bromo-2-propoxyphenyl)-N-(2-methoxyphenyl)-6-methylene-2-oxo-1,3-diazinane-5-carboxamide IUPAC Name: (4S,5R)-4-(5-bromo-2-propoxyphenyl)-N-(2-methoxyphenyl)-6-methylidene-2-oxo-1,3-diazinane-5-carboxamide Traditional Name: (4S,5R)-4-(5-bromo-2-propoxy-phenyl)-2-keto-N-(2-methoxyphenyl)-6-methylene-hexahydropyrimidine-5-carboxamide Formula: C22H24BrN3O4 MolecularWeight: 474.34766

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)Br)C2C(C(=C)NC(=O)N2)C(=O)NC3=CC=CC=C3OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)Br)[C@@H]2[C@H](C(=C)NC(=O)N2)C(=O)NC3=CC=CC=C3OC

InChI

InChI=1S/C22H24BrN3O4/c1-4-11-30-17-10-9-14(23)12-15(17)20-19(13(2)24-22(28)26-20)21(27)25-16-7-5-6-8-18(16)29-3/h5-10,12,19-20H,2,4,11H2,1,3H3,(H,25,27)(H2,24,26,28)/t19-,20+/m0/s1