N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-benzyl-N-(4-methyl-1,3-benzothiazol-2-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide CAS Name: N-(4-methyl-1,3-benzothiazol-2-yl)-N-(phenylmethyl)-2-[4-(2-pyrimidinyl)-1-piperazinyl]acetamide IUPAC Name: N-benzyl-N-(4-methyl-1,3-benzothiazol-2-yl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide Traditional Name: N-benzyl-N-(4-methyl-1,3-benzothiazol-2-yl)-2-[4-(2-pyrimidyl)piperazino]acetamide Formula: C25H26N6OS MolecularWeight: 458.57854

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CN4CCN(CC4)C5=NC=CC=N5

Isomeric SMILES

CC1=C2C(=CC=C1)SC(=N2)N(CC3=CC=CC=C3)C(=O)CN4CCN(CC4)C5=NC=CC=N5

InChI

InChI=1S/C25H26N6OS/c1-19-7-5-10-21-23(19)28-25(33-21)31(17-20-8-3-2-4-9-20)22(32)18-29-13-15-30(16-14-29)24-26-11-6-12-27-24/h2-12H,13-18H2,1H3