(1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl pyrrolidine-1-carbodithioate

Systemtic Name: (1-ethyl-5-piperidin-1-ylsulfonyl-benzimidazol-2-yl)methyl pyrrolidine-1-carbodithioate Openeye Name: [1-ethyl-5-(1-piperidylsulfonyl)benzimidazol-2-yl]methyl pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [1-ethyl-5-(1-piperidinylsulfonyl)-2-benzimidazolyl]methyl ester IUPAC Name: (1-ethyl-5-piperidin-1-ylsulfonylbenzimidazol-2-yl)methyl pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid (1-ethyl-5-piperidinosulfonyl-benzimidazol-2-yl)methyl ester Formula: C20H28N4O2S3 MolecularWeight: 452.65692

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC(=S)N4CCCC4

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCCCC3)N=C1CSC(=S)N4CCCC4

InChI

InChI=1S/C20H28N4O2S3/c1-2-24-18-9-8-16(29(25,26)23-12-4-3-5-13-23)14-17(18)21-19(24)15-28-20(27)22-10-6-7-11-22/h8-9,14H,2-7,10-13,15H2,1H3