1,3-benzothiazol-6-yl-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone

Systemtic Name: 1,3-benzothiazol-6-yl-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Openeye Name: 1,3-benzothiazol-6-yl-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone CAS Name: 1,3-benzothiazol-6-yl-[4-[6-(1-pyrrolidinyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: 1,3-benzothiazol-6-yl-[4-(6-pyrrolidin-1-ylpyrimidin-4-yl)piperazin-1-yl]methanone Traditional Name: 1,3-benzothiazol-6-yl-[4-(6-pyrrolidinopyrimidin-4-yl)piperazino]methanone Formula: C20H22N6OS MolecularWeight: 394.49328

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)N=CS5

Isomeric SMILES

C1CCN(C1)C2=CC(=NC=N2)N3CCN(CC3)C(=O)C4=CC5=C(C=C4)N=CS5

InChI

InChI=1S/C20H22N6OS/c27-20(15-3-4-16-17(11-15)28-14-23-16)26-9-7-25(8-10-26)19-12-18(21-13-22-19)24-5-1-2-6-24/h3-4,11-14H,1-2,5-10H2