methyl N-[2-[5-methyl-1-phenyl-4-(2-phenylazanylpyrimidin-4-yl)pyrazol-3-yl]sulfanylethyl]carbamate

Systemtic Name: methyl N-[2-[5-methyl-1-phenyl-4-(2-phenylazanylpyrimidin-4-yl)pyrazol-3-yl]sulfanylethyl]carbamate Openeye Name: methyl N-[2-[4-(2-anilinopyrimidin-4-yl)-5-methyl-1-phenyl-pyrazol-3-yl]sulfanylethyl]carbamate CAS Name: N-[2-[[4-(2-anilino-4-pyrimidinyl)-5-methyl-1-phenyl-3-pyrazolyl]thio]ethyl]carbamic acid methyl ester IUPAC Name: methyl N-[2-[4-(2-anilinopyrimidin-4-yl)-5-methyl-1-phenylpyrazol-3-yl]sulfanylethyl]carbamate Traditional Name: N-[2-[[4-(2-anilinopyrimidin-4-yl)-5-methyl-1-phenyl-pyrazol-3-yl]thio]ethyl]carbamic acid methyl ester Formula: C24H24N6O2S MolecularWeight: 460.55136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)SCCNC(=O)OC)C3=NC(=NC=C3)NC4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)SCCNC(=O)OC)C3=NC(=NC=C3)NC4=CC=CC=C4

InChI

InChI=1S/C24H24N6O2S/c1-17-21(20-13-14-25-23(28-20)27-18-9-5-3-6-10-18)22(33-16-15-26-24(31)32-2)29-30(17)19-11-7-4-8-12-19/h3-14H,15-16H2,1-2H3,(H,26,31)(H,25,27,28)