3-(4-chloranyl-3-nitro-phenyl)-1-methyl-1-[(4-methylsulfanylphenyl)methyl]urea

Systemtic Name: 3-(4-chloranyl-3-nitro-phenyl)-1-methyl-1-[(4-methylsulfanylphenyl)methyl]urea Openeye Name: 3-(4-chloro-3-nitro-phenyl)-1-methyl-1-[(4-methylsulfanylphenyl)methyl]urea CAS Name: 3-(4-chloro-3-nitrophenyl)-1-methyl-1-[[4-(methylthio)phenyl]methyl]urea IUPAC Name: 3-(4-chloro-3-nitrophenyl)-1-methyl-1-[(4-methylsulfanylphenyl)methyl]urea Traditional Name: 3-(4-chloro-3-nitro-phenyl)-1-methyl-1-[4-(methylthio)benzyl]urea Formula: C16H16ClN3O3S MolecularWeight: 365.83454

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)C(=O)NC2=CC(=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H16ClN3O3S/c1-19(10-11-3-6-13(24-2)7-4-11)16(21)18-12-5-8-14(17)15(9-12)20(22)23/h3-9H,10H2,1-2H3,(H,18,21)