2-methyl-6-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonyl-1,3-benzothiazole

Systemtic Name: 2-methyl-6-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonyl-1,3-benzothiazole Openeye Name: 2-methyl-6-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonyl-1,3-benzothiazole CAS Name: 2-methyl-6-[[4-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]sulfonyl]-1,3-benzothiazole IUPAC Name: 2-methyl-6-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]sulfonyl-1,3-benzothiazole Traditional Name: 2-methyl-6-[4-(6-pyrrolidinopyrimidin-4-yl)piperazino]sulfonyl-1,3-benzothiazole Formula: C20H24N6O2S2 MolecularWeight: 444.57356

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=NC=NC(=C4)N5CCCC5

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)N3CCN(CC3)C4=NC=NC(=C4)N5CCCC5

InChI

InChI=1S/C20H24N6O2S2/c1-15-23-17-5-4-16(12-18(17)29-15)30(27,28)26-10-8-25(9-11-26)20-13-19(21-14-22-20)24-6-2-3-7-24/h4-5,12-14H,2-3,6-11H2,1H3