methyl N-[2-[[5-methyl-4-(2-phenylazanylpyrimidin-4-yl)-1,2-oxazol-3-yl]sulfanyl]ethyl]carbamate

Systemtic Name: methyl N-[2-[[5-methyl-4-(2-phenylazanylpyrimidin-4-yl)-1,2-oxazol-3-yl]sulfanyl]ethyl]carbamate Openeye Name: methyl N-[2-[4-(2-anilinopyrimidin-4-yl)-5-methyl-isoxazol-3-yl]sulfanylethyl]carbamate CAS Name: N-[2-[[4-(2-anilino-4-pyrimidinyl)-5-methyl-3-isoxazolyl]thio]ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[[4-(2-anilinopyrimidin-4-yl)-5-methyl-1,2-oxazol-3-yl]sulfanyl]ethyl]carbamate Traditional Name: N-[2-[[4-(2-anilinopyrimidin-4-yl)-5-methyl-isoxazol-3-yl]thio]ethyl]carbamic acid methyl ester Formula: C18H19N5O3S MolecularWeight: 385.44016

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)SCCNC(=O)OC)C2=NC(=NC=C2)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NO1)SCCNC(=O)OC)C2=NC(=NC=C2)NC3=CC=CC=C3

InChI

InChI=1S/C18H19N5O3S/c1-12-15(16(23-26-12)27-11-10-20-18(24)25-2)14-8-9-19-17(22-14)21-13-6-4-3-5-7-13/h3-9H,10-11H2,1-2H3,(H,20,24)(H,19,21,22)