(2-piperidin-1-yl-1,3-benzothiazol-6-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone

Systemtic Name: (2-piperidin-1-yl-1,3-benzothiazol-6-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Openeye Name: [2-(1-piperidyl)-1,3-benzothiazol-6-yl]-(4-pyrimidin-2-ylpiperazin-1-yl)methanone CAS Name: [2-(1-piperidinyl)-1,3-benzothiazol-6-yl]-[4-(2-pyrimidinyl)-1-piperazinyl]methanone IUPAC Name: (2-piperidin-1-yl-1,3-benzothiazol-6-yl)-(4-pyrimidin-2-ylpiperazin-1-yl)methanone Traditional Name: (2-piperidino-1,3-benzothiazol-6-yl)-[4-(2-pyrimidyl)piperazino]methanone Formula: C21H24N6OS MolecularWeight: 408.51986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)C(=O)N4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

C1CCN(CC1)C2=NC3=C(S2)C=C(C=C3)C(=O)N4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C21H24N6OS/c28-19(25-11-13-26(14-12-25)20-22-7-4-8-23-20)16-5-6-17-18(15-16)29-21(24-17)27-9-2-1-3-10-27/h4-8,15H,1-3,9-14H2