1-butyl-3-(4-cyanophenyl)-1-methyl-urea

Systemtic Name: 1-butyl-3-(4-cyanophenyl)-1-methyl-urea Openeye Name: 1-butyl-3-(4-cyanophenyl)-1-methyl-urea CAS Name: 1-butyl-3-(4-cyanophenyl)-1-methylurea IUPAC Name: 1-butyl-3-(4-cyanophenyl)-1-methylurea Traditional Name: 1-butyl-3-(4-cyanophenyl)-1-methyl-urea Formula: C13H17N3O MolecularWeight: 231.29358

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)C(=O)NC1=CC=C(C=C1)C#N

Isomeric SMILES

CCCCN(C)C(=O)NC1=CC=C(C=C1)C#N

InChI

InChI=1S/C13H17N3O/c1-3-4-9-16(2)13(17)15-12-7-5-11(10-14)6-8-12/h5-8H,3-4,9H2,1-2H3,(H,15,17)