3-propan-2-yl-1-(pyridin-3-ylmethyl)-1-[1-(pyridin-4-ylmethyl)piperidin-4-yl]urea

Systemtic Name: 3-propan-2-yl-1-(pyridin-3-ylmethyl)-1-[1-(pyridin-4-ylmethyl)piperidin-4-yl]urea Openeye Name: 3-isopropyl-1-(3-pyridylmethyl)-1-[1-(4-pyridylmethyl)-4-piperidyl]urea CAS Name: 3-propan-2-yl-1-(3-pyridinylmethyl)-1-[1-(pyridin-4-ylmethyl)-4-piperidinyl]urea IUPAC Name: 3-propan-2-yl-1-(pyridin-3-ylmethyl)-1-[1-(pyridin-4-ylmethyl)piperidin-4-yl]urea Traditional Name: 3-isopropyl-1-(3-pyridylmethyl)-1-[1-(4-pyridylmethyl)-4-piperidyl]urea Formula: C21H29N5O MolecularWeight: 367.48786

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N(CC1=CN=CC=C1)C2CCN(CC2)CC3=CC=NC=C3

Isomeric SMILES

CC(C)NC(=O)N(CC1=CN=CC=C1)C2CCN(CC2)CC3=CC=NC=C3

InChI

InChI=1S/C21H29N5O/c1-17(2)24-21(27)26(16-19-4-3-9-23-14-19)20-7-12-25(13-8-20)15-18-5-10-22-11-6-18/h3-6,9-11,14,17,20H,7-8,12-13,15-16H2,1-2H3,(H,24,27)