1-(2-methoxyphenyl)-3-[2-[1-(2-methylsulfanylethanoyl)piperidin-4-yl]pyrazol-3-yl]urea

Systemtic Name: 1-(2-methoxyphenyl)-3-[2-[1-(2-methylsulfanylethanoyl)piperidin-4-yl]pyrazol-3-yl]urea Openeye Name: 1-(2-methoxyphenyl)-3-[2-[1-(2-methylsulfanylacetyl)-4-piperidyl]pyrazol-3-yl]urea CAS Name: 1-(2-methoxyphenyl)-3-[2-[1-[2-(methylthio)-1-oxoethyl]-4-piperidinyl]-3-pyrazolyl]urea IUPAC Name: 1-(2-methoxyphenyl)-3-[2-[1-(2-methylsulfanylacetyl)piperidin-4-yl]pyrazol-3-yl]urea Traditional Name: 1-(2-methoxyphenyl)-3-[2-[1-[2-(methylthio)acetyl]-4-piperidyl]pyrazol-3-yl]urea Formula: C19H25N5O3S MolecularWeight: 403.4985

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=O)NC2=CC=NN2C3CCN(CC3)C(=O)CSC

Isomeric SMILES

COC1=CC=CC=C1NC(=O)NC2=CC=NN2C3CCN(CC3)C(=O)CSC

InChI

InChI=1S/C19H25N5O3S/c1-27-16-6-4-3-5-15(16)21-19(26)22-17-7-10-20-24(17)14-8-11-23(12-9-14)18(25)13-28-2/h3-7,10,14H,8-9,11-13H2,1-2H3,(H2,21,22,26)