1-(2-methylphenyl)-3-[6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-yl]urea

Systemtic Name: 1-(2-methylphenyl)-3-[6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-yl]urea Openeye Name: 1-[6-(4-isopropylpiperazin-1-yl)-3-pyridyl]-3-(o-tolyl)urea CAS Name: 1-(2-methylphenyl)-3-[6-(4-propan-2-yl-1-piperazinyl)-3-pyridinyl]urea IUPAC Name: 1-(2-methylphenyl)-3-[6-(4-propan-2-ylpiperazin-1-yl)pyridin-3-yl]urea Traditional Name: 1-[6-(4-isopropylpiperazino)-3-pyridyl]-3-(o-tolyl)urea Formula: C20H27N5O MolecularWeight: 353.46128

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=O)NC2=CN=C(C=C2)N3CCN(CC3)C(C)C

Isomeric SMILES

CC1=CC=CC=C1NC(=O)NC2=CN=C(C=C2)N3CCN(CC3)C(C)C

InChI

InChI=1S/C20H27N5O/c1-15(2)24-10-12-25(13-11-24)19-9-8-17(14-21-19)22-20(26)23-18-7-5-4-6-16(18)3/h4-9,14-15H,10-13H2,1-3H3,(H2,22,23,26)