1-hexyl-3-[3-(1-propylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]urea

Systemtic Name: 1-hexyl-3-[3-(1-propylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]urea Openeye Name: 1-hexyl-3-[3-(1-propyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]urea CAS Name: 1-hexyl-3-[3-(1-propyl-4-piperidinyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]urea IUPAC Name: 1-hexyl-3-[3-(1-propylpiperidin-4-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl]urea Traditional Name: 1-hexyl-3-[3-(1-propyl-4-piperidyl)-1H-pyrrolo[3,2-b]pyridin-5-yl]urea Formula: C22H35N5O MolecularWeight: 385.5462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)NC1=NC2=C(C=C1)NC=C2C3CCN(CC3)CCC

Isomeric SMILES

CCCCCCNC(=O)NC1=NC2=C(C=C1)NC=C2C3CCN(CC3)CCC

InChI

InChI=1S/C22H35N5O/c1-3-5-6-7-12-23-22(28)26-20-9-8-19-21(25-20)18(16-24-19)17-10-14-27(13-4-2)15-11-17/h8-9,16-17,24H,3-7,10-15H2,1-2H3,(H2,23,25,26,28)