1-butyl-N,N-dimethyl-3-(morpholin-4-ylmethyl)-2-sulfanylidene-benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-N,N-dimethyl-3-(morpholin-4-ylmethyl)-2-sulfanylidene-benzimidazole-5-sulfonamide Openeye Name: 1-butyl-N,N-dimethyl-3-(morpholinomethyl)-2-thioxo-benzimidazole-5-sulfonamide CAS Name: 1-butyl-N,N-dimethyl-3-(4-morpholinylmethyl)-2-sulfanylidene-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-N,N-dimethyl-3-(morpholin-4-ylmethyl)-2-sulfanylidenebenzimidazole-5-sulfonamide Traditional Name: 1-butyl-N,N-dimethyl-3-(morpholinomethyl)-2-thioxo-benzimidazole-5-sulfonamide Formula: C18H28N4O3S2 MolecularWeight: 412.56992

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N(C1=S)CN3CCOCC3

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N(C1=S)CN3CCOCC3

InChI

InChI=1S/C18H28N4O3S2/c1-4-5-8-21-16-7-6-15(27(23,24)19(2)3)13-17(16)22(18(21)26)14-20-9-11-25-12-10-20/h6-7,13H,4-5,8-12,14H2,1-3H3