(2E)-2-(2-piperazin-1-yl-4-pyrimidin-2-yl-2H-pyrimidin-5-ylidene)-3H-1,3-benzothiazole

Systemtic Name: (2E)-2-(2-piperazin-1-yl-4-pyrimidin-2-yl-2H-pyrimidin-5-ylidene)-3H-1,3-benzothiazole Openeye Name: (2E)-2-(2-piperazin-1-yl-4-pyrimidin-2-yl-2H-pyrimidin-5-ylidene)-3H-1,3-benzothiazole CAS Name: (2E)-2-[2-(1-piperazinyl)-4-(2-pyrimidinyl)-2H-pyrimidin-5-ylidene]-3H-1,3-benzothiazole IUPAC Name: (2E)-2-(2-piperazin-1-yl-4-pyrimidin-2-yl-2H-pyrimidin-5-ylidene)-3H-1,3-benzothiazole Traditional Name: (2E)-2-[2-piperazino-4-(2-pyrimidyl)-2H-pyrimidin-5-ylidene]-3H-1,3-benzothiazole Formula: C19H19N7S MolecularWeight: 377.46606

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2N=CC(=C3NC4=CC=CC=C4S3)C(=N2)C5=NC=CC=N5

Isomeric SMILES

C1CN(CCN1)C2N=C/C(=C\3/NC4=CC=CC=C4S3)/C(=N2)C5=NC=CC=N5

InChI

InChI=1S/C19H19N7S/c1-2-5-15-14(4-1)24-18(27-15)13-12-23-19(26-10-8-20-9-11-26)25-16(13)17-21-6-3-7-22-17/h1-7,12,19-20,24H,8-11H2/b18-13+