methyl 3-azanyl-2-cyano-7-methyl-5-(4-phenylmethoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Systemtic Name: methyl 3-azanyl-2-cyano-7-methyl-5-(4-phenylmethoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Openeye Name: methyl 3-amino-5-(4-benzyloxyphenyl)-2-cyano-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylate CAS Name: 3-amino-2-cyano-7-methyl-5-(4-phenylmethoxyphenyl)-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester IUPAC Name: methyl 3-amino-2-cyano-7-methyl-5-(4-phenylmethoxyphenyl)-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate Traditional Name: 3-amino-5-(4-benzoxyphenyl)-2-cyano-7-methyl-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid methyl ester Formula: C23H20N4O3S MolecularWeight: 432.4949

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(N2C(=C(SC2=N1)C#N)N)C3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(C(N2C(=C(SC2=N1)C#N)N)C3=CC=C(C=C3)OCC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C23H20N4O3S/c1-14-19(22(28)29-2)20(27-21(25)18(12-24)31-23(27)26-14)16-8-10-17(11-9-16)30-13-15-6-4-3-5-7-15/h3-11,20H,13,25H2,1-2H3