2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]-1-[(3S)-3-methyl-4-thiophen-2-ylcarbonyl-piperazin-1-yl]ethanone

Systemtic Name: 2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]-1-[(3S)-3-methyl-4-thiophen-2-ylcarbonyl-piperazin-1-yl]ethanone Openeye Name: 1-[(3S)-3-methyl-4-(thiophene-2-carbonyl)piperazin-1-yl]-2-[5-(m-tolyl)-1,2,4-oxadiazol-3-yl]ethanone CAS Name: 1-[(3S)-3-methyl-4-[oxo(thiophen-2-yl)methyl]-1-piperazinyl]-2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]ethanone IUPAC Name: 2-[5-(3-methylphenyl)-1,2,4-oxadiazol-3-yl]-1-[(3S)-3-methyl-4-(thiophene-2-carbonyl)piperazin-1-yl]ethanone Traditional Name: 1-[(3S)-3-methyl-4-(2-thenoyl)piperazino]-2-[5-(m-tolyl)-1,2,4-oxadiazol-3-yl]ethanone Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)C2=CC=CS2)C(=O)CC3=NOC(=N3)C4=CC(=CC=C4)C

Isomeric SMILES

C[C@H]1CN(CCN1C(=O)C2=CC=CS2)C(=O)CC3=NOC(=N3)C4=CC(=CC=C4)C

InChI

InChI=1S/C21H22N4O3S/c1-14-5-3-6-16(11-14)20-22-18(23-28-20)12-19(26)24-8-9-25(15(2)13-24)21(27)17-7-4-10-29-17/h3-7,10-11,15H,8-9,12-13H2,1-2H3/t15-/m0/s1