1-[(2S)-butan-2-yl]-3-(4-piperidin-1-yl-2,1,3-benzoxadiazol-7-yl)urea

Systemtic Name: 1-[(2S)-butan-2-yl]-3-(4-piperidin-1-yl-2,1,3-benzoxadiazol-7-yl)urea Openeye Name: 1-[(1S)-1-methylpropyl]-3-[4-(1-piperidyl)-2,1,3-benzoxadiazol-7-yl]urea CAS Name: 1-[(2S)-butan-2-yl]-3-[4-(1-piperidinyl)-2,1,3-benzoxadiazol-7-yl]urea IUPAC Name: 1-[(2S)-butan-2-yl]-3-(4-piperidin-1-yl-2,1,3-benzoxadiazol-7-yl)urea Traditional Name: 1-[(1S)-1-methylpropyl]-3-(7-piperidinobenzofurazan-4-yl)urea Formula: C16H23N5O2 MolecularWeight: 317.38612

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)NC1=CC=C(C2=NON=C12)N3CCCCC3

Isomeric SMILES

CC[C@H](C)NC(=O)NC1=CC=C(C2=NON=C12)N3CCCCC3

InChI

InChI=1S/C16H23N5O2/c1-3-11(2)17-16(22)18-12-7-8-13(15-14(12)19-23-20-15)21-9-5-4-6-10-21/h7-8,11H,3-6,9-10H2,1-2H3,(H2,17,18,22)/t11-/m0/s1