1-[5-chloranyl-6-[1-(4-methylthiophen-2-yl)ethylamino]pyrimidin-4-yl]ethyl ethanoate

Systemtic Name: 1-[5-chloranyl-6-[1-(4-methylthiophen-2-yl)ethylamino]pyrimidin-4-yl]ethyl ethanoate Openeye Name: 1-[5-chloro-6-[1-(4-methyl-2-thienyl)ethylamino]pyrimidin-4-yl]ethyl acetate CAS Name: acetic acid 1-[5-chloro-6-[1-(4-methyl-2-thiophenyl)ethylamino]-4-pyrimidinyl]ethyl ester IUPAC Name: 1-[5-chloro-6-[1-(4-methylthiophen-2-yl)ethylamino]pyrimidin-4-yl]ethyl acetate Traditional Name: acetic acid 1-[5-chloro-6-[1-(4-methyl-2-thienyl)ethylamino]pyrimidin-4-yl]ethyl ester Formula: C15H18ClN3O2S MolecularWeight: 339.84032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=C1)C(C)NC2=NC=NC(=C2Cl)C(C)OC(=O)C

Isomeric SMILES

CC1=CSC(=C1)C(C)NC2=NC=NC(=C2Cl)C(C)OC(=O)C

InChI

InChI=1S/C15H18ClN3O2S/c1-8-5-12(22-6-8)9(2)19-15-13(16)14(17-7-18-15)10(3)21-11(4)20/h5-7,9-10H,1-4H3,(H,17,18,19)