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

Systemtic Name: 3-chloranyl-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]aniline Openeye Name: 3-chloro-4-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]aniline CAS Name: 3-chloro-4-[(3,5-dimethyl-4-isoxazolyl)methylthio]aniline IUPAC Name: 3-chloro-4-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]aniline Traditional Name: [3-chloro-4-[(3,5-dimethylisoxazol-4-yl)methylthio]phenyl]amine Formula: C12H13ClN2OS MolecularWeight: 268.76242

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=C(C=C(C=C2)N)Cl

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=C(C=C(C=C2)N)Cl

InChI

InChI=1S/C12H13ClN2OS/c1-7-10(8(2)16-15-7)6-17-12-4-3-9(14)5-11(12)13/h3-5H,6,14H2,1-2H3