4-(5-chloranylthiophen-2-yl)sulfonyl-N-[2-(4-methoxyphenyl)ethyl]piperazine-1-carbothioamide

Systemtic Name: 4-(5-chloranylthiophen-2-yl)sulfonyl-N-[2-(4-methoxyphenyl)ethyl]piperazine-1-carbothioamide Openeye Name: 4-[(5-chloro-2-thienyl)sulfonyl]-N-[2-(4-methoxyphenyl)ethyl]piperazine-1-carbothioamide CAS Name: 4-[(5-chloro-2-thiophenyl)sulfonyl]-N-[2-(4-methoxyphenyl)ethyl]-1-piperazinecarbothioamide IUPAC Name: 4-(5-chlorothiophen-2-yl)sulfonyl-N-[2-(4-methoxyphenyl)ethyl]piperazine-1-carbothioamide Traditional Name: 4-[(5-chloro-2-thienyl)sulfonyl]-N-[2-(4-methoxyphenyl)ethyl]piperazine-1-carbothioamide Formula: C18H22ClN3O3S3 MolecularWeight: 460.03358

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCNC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)CCNC(=S)N2CCN(CC2)S(=O)(=O)C3=CC=C(S3)Cl

InChI

InChI=1S/C18H22ClN3O3S3/c1-25-15-4-2-14(3-5-15)8-9-20-18(26)21-10-12-22(13-11-21)28(23,24)17-7-6-16(19)27-17/h2-7H,8-13H2,1H3,(H,20,26)