ethyl (5S)-2,3-dicyano-7-methyl-5-phenyl-5,8-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate

Systemtic Name: ethyl (5S)-2,3-dicyano-7-methyl-5-phenyl-5,8-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate Openeye Name: ethyl (5S)-2,3-dicyano-7-methyl-5-phenyl-5,8-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate CAS Name: (5S)-2,3-dicyano-7-methyl-5-phenyl-5,8-dihydroimidazo[1,2-a]pyrimidine-6-carboxylic acid ethyl ester IUPAC Name: ethyl (5S)-2,3-dicyano-7-methyl-5-phenyl-5,8-dihydroimidazo[1,2-a]pyrimidine-6-carboxylate Traditional Name: (5S)-2,3-dicyano-7-methyl-5-phenyl-5,8-dihydroimidazo[1,2-a]pyrimidine-6-carboxylic acid ethyl ester Formula: C18H15N5O2 MolecularWeight: 333.344

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=NC(=C(N2C1C3=CC=CC=C3)C#N)C#N)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=NC(=C(N2[C@H]1C3=CC=CC=C3)C#N)C#N)C

InChI

InChI=1S/C18H15N5O2/c1-3-25-17(24)15-11(2)21-18-22-13(9-19)14(10-20)23(18)16(15)12-7-5-4-6-8-12/h4-8,16H,3H2,1-2H3,(H,21,22)/t16-/m0/s1