1-(1,3-benzothiazol-2-ylmethyl)-4-[(6-chloranyl-1,3-benzothiazol-2-yl)sulfonyl]-6-methoxy-piperazin-2-one

Systemtic Name: 1-(1,3-benzothiazol-2-ylmethyl)-4-[(6-chloranyl-1,3-benzothiazol-2-yl)sulfonyl]-6-methoxy-piperazin-2-one Openeye Name: 1-(1,3-benzothiazol-2-ylmethyl)-4-[(6-chloro-1,3-benzothiazol-2-yl)sulfonyl]-6-methoxy-piperazin-2-one CAS Name: 1-(1,3-benzothiazol-2-ylmethyl)-4-[(6-chloro-1,3-benzothiazol-2-yl)sulfonyl]-6-methoxy-2-piperazinone IUPAC Name: 1-(1,3-benzothiazol-2-ylmethyl)-4-[(6-chloro-1,3-benzothiazol-2-yl)sulfonyl]-6-methoxypiperazin-2-one Traditional Name: 1-(1,3-benzothiazol-2-ylmethyl)-4-[(6-chloro-1,3-benzothiazol-2-yl)sulfonyl]-6-methoxy-piperazin-2-one Formula: C20H17ClN4O4S3 MolecularWeight: 509.02138

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Descriptors Computed from Structure

Canonical SMILES:

COC1CN(CC(=O)N1CC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=NC5=C(S4)C=C(C=C5)Cl

Isomeric SMILES

COC1CN(CC(=O)N1CC2=NC3=CC=CC=C3S2)S(=O)(=O)C4=NC5=C(S4)C=C(C=C5)Cl

InChI

InChI=1S/C20H17ClN4O4S3/c1-29-19-11-24(32(27,28)20-23-14-7-6-12(21)8-16(14)31-20)10-18(26)25(19)9-17-22-13-4-2-3-5-15(13)30-17/h2-8,19H,9-11H2,1H3