1-(2,5-dimethylphenyl)-3-(3-ethylpent-1-yn-3-yl)urea

Systemtic Name: 1-(2,5-dimethylphenyl)-3-(3-ethylpent-1-yn-3-yl)urea Openeye Name: 1-(1,1-diethylprop-2-ynyl)-3-(2,5-dimethylphenyl)urea CAS Name: 1-(2,5-dimethylphenyl)-3-(3-ethylpent-1-yn-3-yl)urea IUPAC Name: 1-(2,5-dimethylphenyl)-3-(3-ethylpent-1-yn-3-yl)urea Traditional Name: 1-(1,1-diethylprop-2-ynyl)-3-(2,5-dimethylphenyl)urea Formula: C16H22N2O MolecularWeight: 258.35868

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C#C)NC(=O)NC1=C(C=CC(=C1)C)C

Isomeric SMILES

CCC(CC)(C#C)NC(=O)NC1=C(C=CC(=C1)C)C

InChI

InChI=1S/C16H22N2O/c1-6-16(7-2,8-3)18-15(19)17-14-11-12(4)9-10-13(14)5/h1,9-11H,7-8H2,2-5H3,(H2,17,18,19)