1-[4-(3-tert-butyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-3-(2-methylphenyl)prop-2-yn-1-one

Systemtic Name: 1-[4-(3-tert-butyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-3-(2-methylphenyl)prop-2-yn-1-one Openeye Name: 1-[4-(3-tert-butyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-3-(o-tolyl)prop-2-yn-1-one CAS Name: 1-[4-(3-tert-butyl-1,2,4-thiadiazol-5-yl)-1-piperazinyl]-3-(2-methylphenyl)-2-propyn-1-one IUPAC Name: 1-[4-(3-tert-butyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]-3-(2-methylphenyl)prop-2-yn-1-one Traditional Name: 1-[4-(3-tert-butyl-1,2,4-thiadiazol-5-yl)piperazino]-3-(o-tolyl)prop-2-yn-1-one Formula: C20H24N4OS MolecularWeight: 368.49576

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C#CC(=O)N2CCN(CC2)C3=NC(=NS3)C(C)(C)C

Isomeric SMILES

CC1=CC=CC=C1C#CC(=O)N2CCN(CC2)C3=NC(=NS3)C(C)(C)C

InChI

InChI=1S/C20H24N4OS/c1-15-7-5-6-8-16(15)9-10-17(25)23-11-13-24(14-12-23)19-21-18(22-26-19)20(2,3)4/h5-8H,11-14H2,1-4H3