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

Systemtic Name: 1-[3,5-bis(chloranyl)-4-(2-chloranyl-4-nitro-phenyl)sulfanyl-phenyl]-3-methyl-urea Openeye Name: 1-[3,5-dichloro-4-(2-chloro-4-nitro-phenyl)sulfanyl-phenyl]-3-methyl-urea CAS Name: 1-[3,5-dichloro-4-[(2-chloro-4-nitrophenyl)thio]phenyl]-3-methylurea IUPAC Name: 1-[3,5-dichloro-4-(2-chloro-4-nitrophenyl)sulfanylphenyl]-3-methylurea Traditional Name: 1-[3,5-dichloro-4-[(2-chloro-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)Cl)SC2=C(C=C(C=C2)[N+](=O)[O-])Cl)Cl

Isomeric SMILES

CNC(=O)NC1=CC(=C(C(=C1)Cl)SC2=C(C=C(C=C2)[N+](=O)[O-])Cl)Cl

InChI

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