3-chloranyl-2-(2,4-dinitrophenyl)sulfanyl-6-methyl-aniline

Systemtic Name: 3-chloranyl-2-(2,4-dinitrophenyl)sulfanyl-6-methyl-aniline Openeye Name: 3-chloro-2-(2,4-dinitrophenyl)sulfanyl-6-methyl-aniline CAS Name: 3-chloro-2-[(2,4-dinitrophenyl)thio]-6-methylaniline IUPAC Name: 3-chloro-2-(2,4-dinitrophenyl)sulfanyl-6-methylaniline Traditional Name: [3-chloro-2-[(2,4-dinitrophenyl)thio]-6-methyl-phenyl]amine Formula: C13H10ClN3O4S MolecularWeight: 339.7542

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)Cl)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])N

Isomeric SMILES

CC1=C(C(=C(C=C1)Cl)SC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])N

InChI

InChI=1S/C13H10ClN3O4S/c1-7-2-4-9(14)13(12(7)15)22-11-5-3-8(16(18)19)6-10(11)17(20)21/h2-6H,15H2,1H3