[3-[(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)amino]phenyl] N-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]carbamate

Systemtic Name: [3-[(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)amino]phenyl] N-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]carbamate Openeye Name: [3-[(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)amino]phenyl] N-[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamate CAS Name: N-[2-[3-(1-methylethenyl)phenyl]propan-2-yl]carbamic acid [3-[[6-methyl-2-(methylthio)-4-pyrimidinyl]amino]phenyl] ester IUPAC Name: [3-[(6-methyl-2-methylsulfanylpyrimidin-4-yl)amino]phenyl] N-[2-(3-prop-1-en-2-ylphenyl)propan-2-yl]carbamate Traditional Name: N-[1-(3-isopropenylphenyl)-1-methyl-ethyl]carbamic acid [3-[[6-methyl-2-(methylthio)pyrimidin-4-yl]amino]phenyl] ester Formula: C25H28N4O2S MolecularWeight: 448.58042

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)SC)NC2=CC(=CC=C2)OC(=O)NC(C)(C)C3=CC=CC(=C3)C(=C)C

Isomeric SMILES

CC1=CC(=NC(=N1)SC)NC2=CC(=CC=C2)OC(=O)NC(C)(C)C3=CC=CC(=C3)C(=C)C

InChI

InChI=1S/C25H28N4O2S/c1-16(2)18-9-7-10-19(14-18)25(4,5)29-24(30)31-21-12-8-11-20(15-21)27-22-13-17(3)26-23(28-22)32-6/h7-15H,1H2,2-6H3,(H,29,30)(H,26,27,28)