3-(2-methoxy-5-methyl-phenyl)-1-(pyridin-3-ylmethyl)-1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]urea

Systemtic Name: 3-(2-methoxy-5-methyl-phenyl)-1-(pyridin-3-ylmethyl)-1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]urea Openeye Name: 3-(2-methoxy-5-methyl-phenyl)-1-(3-pyridylmethyl)-1-[1-[2-(2-thienyl)ethyl]-4-piperidyl]urea CAS Name: 3-(2-methoxy-5-methylphenyl)-1-(3-pyridinylmethyl)-1-[1-(2-thiophen-2-ylethyl)-4-piperidinyl]urea IUPAC Name: 3-(2-methoxy-5-methylphenyl)-1-(pyridin-3-ylmethyl)-1-[1-(2-thiophen-2-ylethyl)piperidin-4-yl]urea Traditional Name: 3-(2-methoxy-5-methyl-phenyl)-1-(3-pyridylmethyl)-1-[1-[2-(2-thienyl)ethyl]-4-piperidyl]urea Formula: C26H32N4O2S MolecularWeight: 464.62288

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)N(CC2=CN=CC=C2)C3CCN(CC3)CCC4=CC=CS4

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)N(CC2=CN=CC=C2)C3CCN(CC3)CCC4=CC=CS4

InChI

InChI=1S/C26H32N4O2S/c1-20-7-8-25(32-2)24(17-20)28-26(31)30(19-21-5-3-12-27-18-21)22-9-13-29(14-10-22)15-11-23-6-4-16-33-23/h3-8,12,16-18,22H,9-11,13-15,19H2,1-2H3,(H,28,31)