[3-[(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)amino]phenyl] N-propylcarbamate

Systemtic Name: [3-[(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)amino]phenyl] N-propylcarbamate Openeye Name: [3-[(6-methyl-2-methylsulfanyl-pyrimidin-4-yl)amino]phenyl] N-propylcarbamate CAS Name: N-propylcarbamic acid [3-[[6-methyl-2-(methylthio)-4-pyrimidinyl]amino]phenyl] ester IUPAC Name: [3-[(6-methyl-2-methylsulfanylpyrimidin-4-yl)amino]phenyl] N-propylcarbamate Traditional Name: N-propylcarbamic acid [3-[[6-methyl-2-(methylthio)pyrimidin-4-yl]amino]phenyl] ester Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)OC1=CC=CC(=C1)NC2=NC(=NC(=C2)C)SC

Isomeric SMILES

CCCNC(=O)OC1=CC=CC(=C1)NC2=NC(=NC(=C2)C)SC

InChI

InChI=1S/C16H20N4O2S/c1-4-8-17-16(21)22-13-7-5-6-12(10-13)19-14-9-11(2)18-15(20-14)23-3/h5-7,9-10H,4,8H2,1-3H3,(H,17,21)(H,18,19,20)