2-[(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[(4-amino-2-thieno[2,3-d]pyrimidinyl)thio]methyl]-1-ethyl-N,N-dimethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanylmethyl]-1-ethyl-N,N-dimethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[(4-aminothieno[2,3-d]pyrimidin-2-yl)thio]methyl]-1-ethyl-N,N-dimethyl-benzimidazole-5-sulfonamide Formula: C18H20N6O2S3 MolecularWeight: 448.5854

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CSC3=NC(=C4C=CSC4=N3)N

Isomeric SMILES

CCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1CSC3=NC(=C4C=CSC4=N3)N

InChI

InChI=1S/C18H20N6O2S3/c1-4-24-14-6-5-11(29(25,26)23(2)3)9-13(14)20-15(24)10-28-18-21-16(19)12-7-8-27-17(12)22-18/h5-9H,4,10H2,1-3H3,(H2,19,21,22)