1-(3-ethynylphenyl)-3-(4-methylphenyl)urea

Systemtic Name: 1-(3-ethynylphenyl)-3-(4-methylphenyl)urea Openeye Name: 1-(3-ethynylphenyl)-3-(p-tolyl)urea CAS Name: 1-(3-ethynylphenyl)-3-(4-methylphenyl)urea IUPAC Name: 1-(3-ethynylphenyl)-3-(4-methylphenyl)urea Traditional Name: 1-(3-ethynylphenyl)-3-(p-tolyl)urea Formula: C16H14N2O MolecularWeight: 250.29516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC2=CC=CC(=C2)C#C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC2=CC=CC(=C2)C#C

InChI

InChI=1S/C16H14N2O/c1-3-13-5-4-6-15(11-13)18-16(19)17-14-9-7-12(2)8-10-14/h1,4-11H,2H3,(H2,17,18,19)