1-tert-butyl-3-[6-[4-(pyridin-4-ylmethyl)piperazin-1-yl]pyridin-3-yl]urea

Systemtic Name: 1-tert-butyl-3-[6-[4-(pyridin-4-ylmethyl)piperazin-1-yl]pyridin-3-yl]urea Openeye Name: 1-tert-butyl-3-[6-[4-(4-pyridylmethyl)piperazin-1-yl]-3-pyridyl]urea CAS Name: 1-tert-butyl-3-[6-[4-(pyridin-4-ylmethyl)-1-piperazinyl]-3-pyridinyl]urea IUPAC Name: 1-tert-butyl-3-[6-[4-(pyridin-4-ylmethyl)piperazin-1-yl]pyridin-3-yl]urea Traditional Name: 1-tert-butyl-3-[6-[4-(4-pyridylmethyl)piperazino]-3-pyridyl]urea Formula: C20H28N6O MolecularWeight: 368.47592

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC1=CN=C(C=C1)N2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

CC(C)(C)NC(=O)NC1=CN=C(C=C1)N2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C20H28N6O/c1-20(2,3)24-19(27)23-17-4-5-18(22-14-17)26-12-10-25(11-13-26)15-16-6-8-21-9-7-16/h4-9,14H,10-13,15H2,1-3H3,(H2,23,24,27)