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

Systemtic Name: 5-[4-methoxy-3-[4-(phenylmethyl)piperazin-1-yl]sulfonyl-phenyl]-3,4-dimethyl-1,2-oxazole Openeye Name: 5-[3-(4-benzylpiperazin-1-yl)sulfonyl-4-methoxy-phenyl]-3,4-dimethyl-isoxazole CAS Name: 5-[4-methoxy-3-[[4-(phenylmethyl)-1-piperazinyl]sulfonyl]phenyl]-3,4-dimethylisoxazole IUPAC Name: 5-[3-(4-benzylpiperazin-1-yl)sulfonyl-4-methoxyphenyl]-3,4-dimethyl-1,2-oxazole Traditional Name: 5-[3-(4-benzylpiperazino)sulfonyl-4-methoxy-phenyl]-3,4-dimethyl-isoxazole Formula: C23H27N3O4S MolecularWeight: 441.54318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1C)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

Isomeric SMILES

CC1=C(ON=C1C)C2=CC(=C(C=C2)OC)S(=O)(=O)N3CCN(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C23H27N3O4S/c1-17-18(2)24-30-23(17)20-9-10-21(29-3)22(15-20)31(27,28)26-13-11-25(12-14-26)16-19-7-5-4-6-8-19/h4-10,15H,11-14,16H2,1-3H3