2-[[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-1-(4-methylpiperazin-1-yl)ethanone

Systemtic Name: 2-[[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-1-(4-methylpiperazin-1-yl)ethanone Openeye Name: 2-[[2-(3,4-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methylsulfanyl]-1-(4-methylpiperazin-1-yl)ethanone CAS Name: 2-[[2-(3,4-dimethoxyphenyl)-5-methyl-4-oxazolyl]methylthio]-1-(4-methyl-1-piperazinyl)ethanone IUPAC Name: 2-[[2-(3,4-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methylsulfanyl]-1-(4-methylpiperazin-1-yl)ethanone Traditional Name: 2-[[2-(3,4-dimethoxyphenyl)-5-methyl-oxazol-4-yl]methylthio]-1-(4-methylpiperazino)ethanone Formula: C20H27N3O4S MolecularWeight: 405.51108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=C(O1)C2=CC(=C(C=C2)OC)OC)CSCC(=O)N3CCN(CC3)C

Isomeric SMILES

CC1=C(N=C(O1)C2=CC(=C(C=C2)OC)OC)CSCC(=O)N3CCN(CC3)C

InChI

InChI=1S/C20H27N3O4S/c1-14-16(12-28-13-19(24)23-9-7-22(2)8-10-23)21-20(27-14)15-5-6-17(25-3)18(11-15)26-4/h5-6,11H,7-10,12-13H2,1-4H3