5-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-4-propan-2-yl-phenyl]-3-methyl-1,2-oxazole

Systemtic Name: 5-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-4-propan-2-yl-phenyl]-3-methyl-1,2-oxazole Openeye Name: 5-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-4-isopropyl-phenyl]-3-methyl-isoxazole CAS Name: 5-[3-[[4-(2,3-dimethylphenyl)-1-piperazinyl]sulfonyl]-4-propan-2-ylphenyl]-3-methylisoxazole IUPAC Name: 5-[3-[4-(2,3-dimethylphenyl)piperazin-1-yl]sulfonyl-4-propan-2-ylphenyl]-3-methyl-1,2-oxazole Traditional Name: 5-[3-[4-(2,3-dimethylphenyl)piperazino]sulfonyl-4-isopropyl-phenyl]-3-methyl-isoxazole Formula: C25H31N3O3S MolecularWeight: 453.59694

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C4=CC(=NO4)C)C(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)N2CCN(CC2)S(=O)(=O)C3=C(C=CC(=C3)C4=CC(=NO4)C)C(C)C)C

InChI

InChI=1S/C25H31N3O3S/c1-17(2)22-10-9-21(24-15-19(4)26-31-24)16-25(22)32(29,30)28-13-11-27(12-14-28)23-8-6-7-18(3)20(23)5/h6-10,15-17H,11-14H2,1-5H3