1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-1-one

Systemtic Name: 1-[4-(6-methyl-2-propan-2-yl-pyrimidin-4-yl)piperazin-1-yl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-1-one Openeye Name: 1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazin-1-yl]-3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propan-1-one CAS Name: 1-[4-(6-methyl-2-propan-2-yl-4-pyrimidinyl)-1-piperazinyl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)-1-propanone IUPAC Name: 1-[4-(6-methyl-2-propan-2-ylpyrimidin-4-yl)piperazin-1-yl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propan-1-one Traditional Name: 1-[4-(2-isopropyl-6-methyl-pyrimidin-4-yl)piperazino]-3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propan-1-one Formula: C21H26N6O2S MolecularWeight: 426.53514

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)CCC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

CC1=CC(=NC(=N1)C(C)C)N2CCN(CC2)C(=O)CCC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C21H26N6O2S/c1-14(2)20-22-15(3)13-17(23-20)26-8-10-27(11-9-26)19(28)7-6-18-24-21(25-29-18)16-5-4-12-30-16/h4-5,12-14H,6-11H2,1-3H3