(2-methyl-5-methylsulfanyl-phenyl)-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone

Systemtic Name: (2-methyl-5-methylsulfanyl-phenyl)-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone Openeye Name: (2-methyl-5-methylsulfanyl-phenyl)-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone CAS Name: [2-methyl-5-(methylthio)phenyl]-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]-1-piperazinyl]methanone IUPAC Name: (2-methyl-5-methylsulfanylphenyl)-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]methanone Traditional Name: [2-methyl-5-(methylthio)phenyl]-[4-[(3-phenyl-1,2,4-oxadiazol-5-yl)methyl]piperazino]methanone Formula: C22H24N4O2S MolecularWeight: 408.51656

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)SC)C(=O)N2CCN(CC2)CC3=NC(=NO3)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)SC)C(=O)N2CCN(CC2)CC3=NC(=NO3)C4=CC=CC=C4

InChI

InChI=1S/C22H24N4O2S/c1-16-8-9-18(29-2)14-19(16)22(27)26-12-10-25(11-13-26)15-20-23-21(24-28-20)17-6-4-3-5-7-17/h3-9,14H,10-13,15H2,1-2H3