1-(2-imidazol-1-ylethyl)-3-(4-iodophenyl)urea

Systemtic Name: 1-(2-imidazol-1-ylethyl)-3-(4-iodophenyl)urea Openeye Name: 1-(2-imidazol-1-ylethyl)-3-(4-iodophenyl)urea CAS Name: 1-[2-(1-imidazolyl)ethyl]-3-(4-iodophenyl)urea IUPAC Name: 1-(2-imidazol-1-ylethyl)-3-(4-iodophenyl)urea Traditional Name: 1-(2-imidazol-1-ylethyl)-3-(4-iodophenyl)urea Formula: C12H13IN4O MolecularWeight: 356.16229

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)NCCN2C=CN=C2)I

Isomeric SMILES

C1=CC(=CC=C1NC(=O)NCCN2C=CN=C2)I

InChI

InChI=1S/C12H13IN4O/c13-10-1-3-11(4-2-10)16-12(18)15-6-8-17-7-5-14-9-17/h1-5,7,9H,6,8H2,(H2,15,16,18)