N-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-2-oxidanyl-propanamide

Systemtic Name: N-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-2-oxidanyl-propanamide Openeye Name: N-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-2-hydroxy-propanamide CAS Name: N-[3-[2-[4-(1,2-benzothiazol-3-yl)-1-piperazinyl]ethyl]phenyl]-2-hydroxypropanamide IUPAC Name: N-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]ethyl]phenyl]-2-hydroxypropanamide Traditional Name: N-[3-[2-[4-(1,2-benzothiazol-3-yl)piperazino]ethyl]phenyl]-2-hydroxy-propionamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC(=C1)CCN2CCN(CC2)C3=NSC4=CC=CC=C43)O

Isomeric SMILES

CC(C(=O)NC1=CC=CC(=C1)CCN2CCN(CC2)C3=NSC4=CC=CC=C43)O

InChI

InChI=1S/C22H26N4O2S/c1-16(27)22(28)23-18-6-4-5-17(15-18)9-10-25-11-13-26(14-12-25)21-19-7-2-3-8-20(19)29-24-21/h2-8,15-16,27H,9-14H2,1H3,(H,23,28)