3-chloranyl-2-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methylsulfanyl]aniline

Systemtic Name: 3-chloranyl-2-[(5-chloranyl-1,3-dimethyl-pyrazol-4-yl)methylsulfanyl]aniline Openeye Name: 3-chloro-2-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methylsulfanyl]aniline CAS Name: 3-chloro-2-[(5-chloro-1,3-dimethyl-4-pyrazolyl)methylthio]aniline IUPAC Name: 3-chloro-2-[(5-chloro-1,3-dimethylpyrazol-4-yl)methylsulfanyl]aniline Traditional Name: [3-chloro-2-[(5-chloro-1,3-dimethyl-pyrazol-4-yl)methylthio]phenyl]amine Formula: C12H13Cl2N3S MolecularWeight: 302.22272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CSC2=C(C=CC=C2Cl)N)Cl)C

Isomeric SMILES

CC1=NN(C(=C1CSC2=C(C=CC=C2Cl)N)Cl)C

InChI

InChI=1S/C12H13Cl2N3S/c1-7-8(12(14)17(2)16-7)6-18-11-9(13)4-3-5-10(11)15/h3-5H,6,15H2,1-2H3