(5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl pyrrolidine-1-carbodithioate

Systemtic Name: (5-morpholin-4-ylsulfonyl-1-propyl-benzimidazol-2-yl)methyl pyrrolidine-1-carbodithioate Openeye Name: (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl pyrrolidine-1-carbodithioate CAS Name: 1-pyrrolidinecarbodithioic acid [5-(4-morpholinylsulfonyl)-1-propyl-2-benzimidazolyl]methyl ester IUPAC Name: (5-morpholin-4-ylsulfonyl-1-propylbenzimidazol-2-yl)methyl pyrrolidine-1-carbodithioate Traditional Name: pyrrolidine-1-carbodithioic acid (5-morpholinosulfonyl-1-propyl-benzimidazol-2-yl)methyl ester Formula: C20H28N4O3S3 MolecularWeight: 468.65632

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC(=S)N4CCCC4

Isomeric SMILES

CCCN1C2=C(C=C(C=C2)S(=O)(=O)N3CCOCC3)N=C1CSC(=S)N4CCCC4

InChI

InChI=1S/C20H28N4O3S3/c1-2-7-24-18-6-5-16(30(25,26)23-10-12-27-13-11-23)14-17(18)21-19(24)15-29-20(28)22-8-3-4-9-22/h5-6,14H,2-4,7-13,15H2,1H3