1-(3-methoxyphenyl)-3-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridin-3-yl]urea

Systemtic Name: 1-(3-methoxyphenyl)-3-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridin-3-yl]urea Openeye Name: 1-[6-(4-isobutylpiperazin-1-yl)-3-pyridyl]-3-(3-methoxyphenyl)urea CAS Name: 1-(3-methoxyphenyl)-3-[6-[4-(2-methylpropyl)-1-piperazinyl]-3-pyridinyl]urea IUPAC Name: 1-(3-methoxyphenyl)-3-[6-[4-(2-methylpropyl)piperazin-1-yl]pyridin-3-yl]urea Traditional Name: 1-[6-(4-isobutylpiperazino)-3-pyridyl]-3-(3-methoxyphenyl)urea Formula: C21H29N5O2 MolecularWeight: 383.48726

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1CCN(CC1)C2=NC=C(C=C2)NC(=O)NC3=CC(=CC=C3)OC

Isomeric SMILES

CC(C)CN1CCN(CC1)C2=NC=C(C=C2)NC(=O)NC3=CC(=CC=C3)OC

InChI

InChI=1S/C21H29N5O2/c1-16(2)15-25-9-11-26(12-10-25)20-8-7-18(14-22-20)24-21(27)23-17-5-4-6-19(13-17)28-3/h4-8,13-14,16H,9-12,15H2,1-3H3,(H2,23,24,27)