1-[4-[2,6-bis(chloranyl)-4-nitro-phenyl]sulfanyl-3-chloranyl-phenyl]-3-methyl-urea

Systemtic Name: 1-[4-[2,6-bis(chloranyl)-4-nitro-phenyl]sulfanyl-3-chloranyl-phenyl]-3-methyl-urea Openeye Name: 1-[3-chloro-4-(2,6-dichloro-4-nitro-phenyl)sulfanyl-phenyl]-3-methyl-urea CAS Name: 1-[3-chloro-4-[(2,6-dichloro-4-nitrophenyl)thio]phenyl]-3-methylurea IUPAC Name: 1-[3-chloro-4-(2,6-dichloro-4-nitrophenyl)sulfanylphenyl]-3-methylurea Traditional Name: 1-[3-chloro-4-[(2,6-dichloro-4-nitro-phenyl)thio]phenyl]-3-methyl-urea Formula: C14H10Cl3N3O3S MolecularWeight: 406.6715

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)NC1=CC(=C(C=C1)SC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

CNC(=O)NC1=CC(=C(C=C1)SC2=C(C=C(C=C2Cl)[N+](=O)[O-])Cl)Cl

InChI

InChI=1S/C14H10Cl3N3O3S/c1-18-14(21)19-7-2-3-12(9(15)4-7)24-13-10(16)5-8(20(22)23)6-11(13)17/h2-6H,1H3,(H2,18,19,21)