methyl 2-(1,3-benzothiazol-2-ylamino)-5-(methoxymethyl)pyrimidine-4-carboxylate

Systemtic Name: methyl 2-(1,3-benzothiazol-2-ylamino)-5-(methoxymethyl)pyrimidine-4-carboxylate Openeye Name: methyl 2-(1,3-benzothiazol-2-ylamino)-5-(methoxymethyl)pyrimidine-4-carboxylate CAS Name: 2-(1,3-benzothiazol-2-ylamino)-5-(methoxymethyl)-4-pyrimidinecarboxylic acid methyl ester IUPAC Name: methyl 2-(1,3-benzothiazol-2-ylamino)-5-(methoxymethyl)pyrimidine-4-carboxylate Traditional Name: 2-(1,3-benzothiazol-2-ylamino)-5-(methoxymethyl)pyrimidine-4-carboxylic acid methyl ester Formula: C15H14N4O3S MolecularWeight: 330.36166

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCC1=CN=C(N=C1C(=O)OC)NC2=NC3=CC=CC=C3S2

Isomeric SMILES

COCC1=CN=C(N=C1C(=O)OC)NC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C15H14N4O3S/c1-21-8-9-7-16-14(18-12(9)13(20)22-2)19-15-17-10-5-3-4-6-11(10)23-15/h3-7H,8H2,1-2H3,(H,16,17,18,19)