ethyl 4-[2-(4-butylthiophen-2-yl)ethylamino]-6-ethyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-[2-(4-butylthiophen-2-yl)ethylamino]-6-ethyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-[2-(4-butyl-2-thienyl)ethylamino]-6-ethyl-pyrimidine-5-carboxylate CAS Name: 4-[2-(4-butyl-2-thiophenyl)ethylamino]-6-ethyl-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-butylthiophen-2-yl)ethylamino]-6-ethylpyrimidine-5-carboxylate Traditional Name: 4-[2-(4-butyl-2-thienyl)ethylamino]-6-ethyl-pyrimidine-5-carboxylic acid ethyl ester Formula: C19H27N3O2S MolecularWeight: 361.50158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CSC(=C1)CCNC2=NC=NC(=C2C(=O)OCC)CC

Isomeric SMILES

CCCCC1=CSC(=C1)CCNC2=NC=NC(=C2C(=O)OCC)CC

InChI

InChI=1S/C19H27N3O2S/c1-4-7-8-14-11-15(25-12-14)9-10-20-18-17(19(23)24-6-3)16(5-2)21-13-22-18/h11-13H,4-10H2,1-3H3,(H,20,21,22)