1-[4-(6-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-(4-chlorophenyl)sulfanyl-butan-1-one

Systemtic Name: 1-[4-(6-chloranyl-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-(4-chlorophenyl)sulfanyl-butan-1-one Openeye Name: 1-[4-(6-chloro-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-(4-chlorophenyl)sulfanyl-butan-1-one CAS Name: 1-[4-(6-chloro-1,3-benzothiazol-2-yl)-1-piperazinyl]-4-[(4-chlorophenyl)thio]-1-butanone IUPAC Name: 1-[4-(6-chloro-1,3-benzothiazol-2-yl)piperazin-1-yl]-4-(4-chlorophenyl)sulfanylbutan-1-one Traditional Name: 1-[4-(6-chloro-1,3-benzothiazol-2-yl)piperazino]-4-[(4-chlorophenyl)thio]butan-1-one Formula: C21H21Cl2N3OS2 MolecularWeight: 466.44694

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)Cl)C(=O)CCCSC4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=NC3=C(S2)C=C(C=C3)Cl)C(=O)CCCSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C21H21Cl2N3OS2/c22-15-3-6-17(7-4-15)28-13-1-2-20(27)25-9-11-26(12-10-25)21-24-18-8-5-16(23)14-19(18)29-21/h3-8,14H,1-2,9-13H2