1-[4-[(2-pyrrol-1-yl-1,3-benzothiazol-6-yl)carbonyl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[(2-pyrrol-1-yl-1,3-benzothiazol-6-yl)carbonyl]piperazin-1-yl]ethanone Openeye Name: 1-[4-(2-pyrrol-1-yl-1,3-benzothiazole-6-carbonyl)piperazin-1-yl]ethanone CAS Name: 1-[4-[oxo-[2-(1-pyrrolyl)-1,3-benzothiazol-6-yl]methyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-(2-pyrrol-1-yl-1,3-benzothiazole-6-carbonyl)piperazin-1-yl]ethanone Traditional Name: 1-[4-(2-pyrrol-1-yl-1,3-benzothiazole-6-carbonyl)piperazino]ethanone Formula: C18H18N4O2S MolecularWeight: 354.42612

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C2=CC3=C(C=C2)N=C(S3)N4C=CC=C4

InChI

InChI=1S/C18H18N4O2S/c1-13(23)20-8-10-21(11-9-20)17(24)14-4-5-15-16(12-14)25-18(19-15)22-6-2-3-7-22/h2-7,12H,8-11H2,1H3