4-[(3-chloranyl-5-phenyl-1,2,4-triazol-1-yl)sulfonyl]-3,4-dimethyl-5H-1,2-oxazole

Systemtic Name: 4-[(3-chloranyl-5-phenyl-1,2,4-triazol-1-yl)sulfonyl]-3,4-dimethyl-5H-1,2-oxazole Openeye Name: 4-[(3-chloro-5-phenyl-1,2,4-triazol-1-yl)sulfonyl]-3,4-dimethyl-5H-isoxazole CAS Name: 4-[(3-chloro-5-phenyl-1,2,4-triazol-1-yl)sulfonyl]-3,4-dimethyl-5H-isoxazole IUPAC Name: 4-[(3-chloro-5-phenyl-1,2,4-triazol-1-yl)sulfonyl]-3,4-dimethyl-5H-1,2-oxazole Traditional Name: 4-[(3-chloro-5-phenyl-1,2,4-triazol-1-yl)sulfonyl]-3,4-dimethyl-2-isoxazoline Formula: C13H13ClN4O3S MolecularWeight: 340.78532

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOCC1(C)S(=O)(=O)N2C(=NC(=N2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NOCC1(C)S(=O)(=O)N2C(=NC(=N2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C13H13ClN4O3S/c1-9-13(2,8-21-17-9)22(19,20)18-11(15-12(14)16-18)10-6-4-3-5-7-10/h3-7H,8H2,1-2H3