1-[1-(5-methylfuran-2-yl)ethyl]-3-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]urea

Systemtic Name: 1-[1-(5-methylfuran-2-yl)ethyl]-3-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]urea Openeye Name: 1-[1-(5-methyl-2-furyl)ethyl]-3-[6-(3-oxopiperazin-1-yl)-3-pyridyl]urea CAS Name: 1-[1-(5-methyl-2-furanyl)ethyl]-3-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]urea IUPAC Name: 1-[1-(5-methylfuran-2-yl)ethyl]-3-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]urea Traditional Name: 1-[6-(3-ketopiperazino)-3-pyridyl]-3-[1-(5-methyl-2-furyl)ethyl]urea Formula: C17H21N5O3 MolecularWeight: 343.38034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(C)NC(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

CC1=CC=C(O1)C(C)NC(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C17H21N5O3/c1-11-3-5-14(25-11)12(2)20-17(24)21-13-4-6-15(19-9-13)22-8-7-18-16(23)10-22/h3-6,9,12H,7-8,10H2,1-2H3,(H,18,23)(H2,20,21,24)