methyl 2-[1-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]piperazin-2-yl]ethanoate

Systemtic Name: methyl 2-[1-[(6-chloranyl-1-benzothiophen-2-yl)sulfonyl]piperazin-2-yl]ethanoate Openeye Name: methyl 2-[1-(6-chlorobenzothiophen-2-yl)sulfonylpiperazin-2-yl]acetate CAS Name: 2-[1-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]-2-piperazinyl]acetic acid methyl ester IUPAC Name: methyl 2-[1-[(6-chloro-1-benzothiophen-2-yl)sulfonyl]piperazin-2-yl]acetate Traditional Name: 2-[1-(6-chlorobenzothiophen-2-yl)sulfonylpiperazin-2-yl]acetic acid methyl ester Formula: C15H17ClN2O4S2 MolecularWeight: 388.88948

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1CNCCN1S(=O)(=O)C2=CC3=C(S2)C=C(C=C3)Cl

Isomeric SMILES

COC(=O)CC1CNCCN1S(=O)(=O)C2=CC3=C(S2)C=C(C=C3)Cl

InChI

InChI=1S/C15H17ClN2O4S2/c1-22-14(19)8-12-9-17-4-5-18(12)24(20,21)15-6-10-2-3-11(16)7-13(10)23-15/h2-3,6-7,12,17H,4-5,8-9H2,1H3