1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-4-phenyl-butane-1,4-dione

Systemtic Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-4-phenyl-butane-1,4-dione Openeye Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-4-phenyl-butane-1,4-dione CAS Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)-1-piperazinyl]-4-phenylbutane-1,4-dione IUPAC Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)piperazin-1-yl]-4-phenylbutane-1,4-dione Traditional Name: 1-[4-(1,3-benzothiazol-2-ylmethyl)piperazino]-4-phenyl-butane-1,4-dione Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3S2)C(=O)CCC(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3S2)C(=O)CCC(=O)C4=CC=CC=C4

InChI

InChI=1S/C22H23N3O2S/c26-19(17-6-2-1-3-7-17)10-11-22(27)25-14-12-24(13-15-25)16-21-23-18-8-4-5-9-20(18)28-21/h1-9H,10-16H2