5-(1,3-benzothiazol-2-yl)-1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]pentan-1-one

Systemtic Name: 5-(1,3-benzothiazol-2-yl)-1-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]pentan-1-one Openeye Name: 5-(1,3-benzothiazol-2-yl)-1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]pentan-1-one CAS Name: 5-(1,3-benzothiazol-2-yl)-1-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-1-pentanone IUPAC Name: 5-(1,3-benzothiazol-2-yl)-1-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]pentan-1-one Traditional Name: 5-(1,3-benzothiazol-2-yl)-1-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]pentan-1-one Formula: C20H22ClN3O3S3 MolecularWeight: 484.05498

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(=O)CCCCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1CN(CCN1C(=O)CCCCC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C20H22ClN3O3S3/c21-17-9-10-20(29-17)30(26,27)24-13-11-23(12-14-24)19(25)8-4-3-7-18-22-15-5-1-2-6-16(15)28-18/h1-2,5-6,9-10H,3-4,7-8,11-14H2