1-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-3-phenethyl-urea

Systemtic Name: 1-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]-3-phenethyl-urea Openeye Name: 1-[6-(3-oxopiperazin-1-yl)-3-pyridyl]-3-phenethyl-urea CAS Name: 1-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]-3-phenethylurea IUPAC Name: 1-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]-3-phenethylurea Traditional Name: 1-[6-(3-ketopiperazino)-3-pyridyl]-3-phenethyl-urea Formula: C18H21N5O2 MolecularWeight: 339.39164

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)NCCC3=CC=CC=C3

Isomeric SMILES

C1CN(CC(=O)N1)C2=NC=C(C=C2)NC(=O)NCCC3=CC=CC=C3

InChI

InChI=1S/C18H21N5O2/c24-17-13-23(11-10-19-17)16-7-6-15(12-21-16)22-18(25)20-9-8-14-4-2-1-3-5-14/h1-7,12H,8-11,13H2,(H,19,24)(H2,20,22,25)