ethyl 2-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]amino]-6-thiophen-2-yl-pyrimidine-4-carboxylate

Systemtic Name: ethyl 2-[[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]amino]-6-thiophen-2-yl-pyrimidine-4-carboxylate Openeye Name: ethyl 2-[3-methoxy-4-(4-methylimidazol-1-yl)anilino]-6-(2-thienyl)pyrimidine-4-carboxylate CAS Name: 2-[3-methoxy-4-(4-methyl-1-imidazolyl)anilino]-6-thiophen-2-yl-4-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[3-methoxy-4-(4-methylimidazol-1-yl)anilino]-6-thiophen-2-ylpyrimidine-4-carboxylate Traditional Name: 2-[3-methoxy-4-(4-methylimidazol-1-yl)anilino]-6-(2-thienyl)pyrimidine-4-carboxylic acid ethyl ester Formula: C22H21N5O3S MolecularWeight: 435.49884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=NC(=NC(=C1)C2=CC=CS2)NC3=CC(=C(C=C3)N4C=C(N=C4)C)OC

Isomeric SMILES

CCOC(=O)C1=NC(=NC(=C1)C2=CC=CS2)NC3=CC(=C(C=C3)N4C=C(N=C4)C)OC

InChI

InChI=1S/C22H21N5O3S/c1-4-30-21(28)17-11-16(20-6-5-9-31-20)25-22(26-17)24-15-7-8-18(19(10-15)29-3)27-12-14(2)23-13-27/h5-13H,4H2,1-3H3,(H,24,25,26)