2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-4,7-dimethoxy-1,3-benzothiazole

Systemtic Name: 2-[4-(5-chloranylthiophen-2-yl)sulfonylpiperazin-1-yl]-4,7-dimethoxy-1,3-benzothiazole Openeye Name: 2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazin-1-yl]-4,7-dimethoxy-1,3-benzothiazole CAS Name: 2-[4-[(5-chloro-2-thiophenyl)sulfonyl]-1-piperazinyl]-4,7-dimethoxy-1,3-benzothiazole IUPAC Name: 2-[4-(5-chlorothiophen-2-yl)sulfonylpiperazin-1-yl]-4,7-dimethoxy-1,3-benzothiazole Traditional Name: 2-[4-[(5-chloro-2-thienyl)sulfonyl]piperazino]-4,7-dimethoxy-1,3-benzothiazole Formula: C17H18ClN3O4S3 MolecularWeight: 459.99052

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=C(C=C1)OC)SC(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

COC1=C2C(=C(C=C1)OC)SC(=N2)N3CCN(CC3)S(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C17H18ClN3O4S3/c1-24-11-3-4-12(25-2)16-15(11)19-17(27-16)20-7-9-21(10-8-20)28(22,23)14-6-5-13(18)26-14/h3-6H,7-10H2,1-2H3