3,5-dimethyl-4-[4-(2-methylsulfanylphenyl)piperazin-1-yl]sulfonyl-1,2-oxazole

Systemtic Name: 3,5-dimethyl-4-[4-(2-methylsulfanylphenyl)piperazin-1-yl]sulfonyl-1,2-oxazole Openeye Name: 3,5-dimethyl-4-[4-(2-methylsulfanylphenyl)piperazin-1-yl]sulfonyl-isoxazole CAS Name: 3,5-dimethyl-4-[[4-[2-(methylthio)phenyl]-1-piperazinyl]sulfonyl]isoxazole IUPAC Name: 3,5-dimethyl-4-[4-(2-methylsulfanylphenyl)piperazin-1-yl]sulfonyl-1,2-oxazole Traditional Name: 3,5-dimethyl-4-[4-[2-(methylthio)phenyl]piperazino]sulfonyl-isoxazole Formula: C16H21N3O3S2 MolecularWeight: 367.48624

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3SC

Isomeric SMILES

CC1=C(C(=NO1)C)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3SC

InChI

InChI=1S/C16H21N3O3S2/c1-12-16(13(2)22-17-12)24(20,21)19-10-8-18(9-11-19)14-6-4-5-7-15(14)23-3/h4-7H,8-11H2,1-3H3