2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]ethanone

Systemtic Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1-[4-(4-ethylphenyl)carbonylpiperazin-1-yl]ethanone Openeye Name: 2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]-1-[4-(4-ethylbenzoyl)piperazin-1-yl]ethanone CAS Name: 2-[(3,5-dimethyl-4-isoxazolyl)methylthio]-1-[4-[(4-ethylphenyl)-oxomethyl]-1-piperazinyl]ethanone IUPAC Name: 2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]-1-[4-(4-ethylbenzoyl)piperazin-1-yl]ethanone Traditional Name: 2-[(3,5-dimethylisoxazol-4-yl)methylthio]-1-[4-(4-ethylbenzoyl)piperazino]ethanone Formula: C21H27N3O3S MolecularWeight: 401.52238

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CSCC3=C(ON=C3C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)CSCC3=C(ON=C3C)C

InChI

InChI=1S/C21H27N3O3S/c1-4-17-5-7-18(8-6-17)21(26)24-11-9-23(10-12-24)20(25)14-28-13-19-15(2)22-27-16(19)3/h5-8H,4,9-14H2,1-3H3