3-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-phenylpiperazin-1-yl)propan-1-one

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-phenylpiperazin-1-yl)propan-1-one Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-phenylpiperazin-1-yl)propan-1-one CAS Name: 3-(1,3-benzothiazol-2-ylthio)-1-(4-phenyl-1-piperazinyl)-1-propanone IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-1-(4-phenylpiperazin-1-yl)propan-1-one Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-1-(4-phenylpiperazino)propan-1-one Formula: C20H21N3OS2 MolecularWeight: 383.53024

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C(=O)CCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C(=O)CCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H21N3OS2/c24-19(10-15-25-20-21-17-8-4-5-9-18(17)26-20)23-13-11-22(12-14-23)16-6-2-1-3-7-16/h1-9H,10-15H2