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

Systemtic Name: 1-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-3-thiophen-2-yl-but-2-en-1-one Openeye Name: 1-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-3-(2-thienyl)but-2-en-1-one CAS Name: 1-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]-3-thiophen-2-yl-2-buten-1-one IUPAC Name: 1-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-3-thiophen-2-ylbut-2-en-1-one Traditional Name: 1-[4-(1,2-benzothiazol-3-yl)piperazino]-3-(2-thienyl)but-2-en-1-one Formula: C19H19N3OS2 MolecularWeight: 369.50366

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)N1CCN(CC1)C2=NSC3=CC=CC=C32)C4=CC=CS4

Isomeric SMILES

CC(=CC(=O)N1CCN(CC1)C2=NSC3=CC=CC=C32)C4=CC=CS4

InChI

InChI=1S/C19H19N3OS2/c1-14(16-7-4-12-24-16)13-18(23)21-8-10-22(11-9-21)19-15-5-2-3-6-17(15)25-20-19/h2-7,12-13H,8-11H2,1H3