(E)-1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]but-2-en-1-one

Systemtic Name: (E)-1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]but-2-en-1-one Openeye Name: (E)-1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]but-2-en-1-one CAS Name: (E)-1-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-2-buten-1-one IUPAC Name: (E)-1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]but-2-en-1-one Traditional Name: (E)-1-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]but-2-en-1-one Formula: C16H19N3OS MolecularWeight: 301.40656

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC(=O)N1CCN(CC1)CC2=NC3=CC=CC=C3S2

Isomeric SMILES

C/C=C/C(=O)N1CCN(CC1)CC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H19N3OS/c1-2-5-16(20)19-10-8-18(9-11-19)12-15-17-13-6-3-4-7-14(13)21-15/h2-7H,8-12H2,1H3/b5-2+