1-[4-(azepan-1-yl)but-2-ynyl]-1,3-dimethyl-urea

Systemtic Name: 1-[4-(azepan-1-yl)but-2-ynyl]-1,3-dimethyl-urea Openeye Name: 1-[4-(azepan-1-yl)but-2-ynyl]-1,3-dimethyl-urea CAS Name: 1-[4-(1-azepanyl)but-2-ynyl]-1,3-dimethylurea IUPAC Name: 1-[4-(azepan-1-yl)but-2-ynyl]-1,3-dimethylurea Traditional Name: 1-[4-(azepan-1-yl)but-2-ynyl]-1,3-dimethyl-urea Formula: C13H23N3O MolecularWeight: 237.34122

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)N(C)CC#CCN1CCCCCC1

Isomeric SMILES

CNC(=O)N(C)CC#CCN1CCCCCC1

InChI

InChI=1S/C13H23N3O/c1-14-13(17)15(2)9-7-8-12-16-10-5-3-4-6-11-16/h3-6,9-12H2,1-2H3,(H,14,17)