1-[3,5-bis(chloranyl)-4-(2-chloranyl-4-cyano-phenyl)sulfanyl-phenyl]-3-ethyl-urea

Systemtic Name: 1-[3,5-bis(chloranyl)-4-(2-chloranyl-4-cyano-phenyl)sulfanyl-phenyl]-3-ethyl-urea Openeye Name: 1-[3,5-dichloro-4-(2-chloro-4-cyano-phenyl)sulfanyl-phenyl]-3-ethyl-urea CAS Name: 1-[3,5-dichloro-4-[(2-chloro-4-cyanophenyl)thio]phenyl]-3-ethylurea IUPAC Name: 1-[3,5-dichloro-4-(2-chloro-4-cyanophenyl)sulfanylphenyl]-3-ethylurea Traditional Name: 1-[3,5-dichloro-4-[(2-chloro-4-cyano-phenyl)thio]phenyl]-3-ethyl-urea Formula: C16H12Cl3N3OS MolecularWeight: 400.70998

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)NC1=CC(=C(C(=C1)Cl)SC2=C(C=C(C=C2)C#N)Cl)Cl

Isomeric SMILES

CCNC(=O)NC1=CC(=C(C(=C1)Cl)SC2=C(C=C(C=C2)C#N)Cl)Cl

InChI

InChI=1S/C16H12Cl3N3OS/c1-2-21-16(23)22-10-6-12(18)15(13(19)7-10)24-14-4-3-9(8-20)5-11(14)17/h3-7H,2H2,1H3,(H2,21,22,23)