1-[4-(4-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenylsulfanyl-propan-1-one

Systemtic Name: 1-[4-(4-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenylsulfanyl-propan-1-one Openeye Name: 1-[4-(4-chloro-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenylsulfanyl-propan-1-one CAS Name: 1-[4-(4-chloro-1,3-benzothiazol-2-yl)-1-piperazinyl]-3-(phenylthio)-1-propanone IUPAC Name: 1-[4-(4-chloro-1,3-benzothiazol-2-yl)piperazin-1-yl]-3-phenylsulfanylpropan-1-one Traditional Name: 1-[4-(4-chloro-1,3-benzothiazol-2-yl)piperazino]-3-(phenylthio)propan-1-one Formula: C20H20ClN3OS2 MolecularWeight: 417.9753

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=CC=C3Cl)C(=O)CCSC4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=CC=C3Cl)C(=O)CCSC4=CC=CC=C4

InChI

InChI=1S/C20H20ClN3OS2/c21-16-7-4-8-17-19(16)22-20(27-17)24-12-10-23(11-13-24)18(25)9-14-26-15-5-2-1-3-6-15/h1-8H,9-14H2