1-butyl-N,N-dimethyl-2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-N,N-dimethyl-2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-benzimidazole-5-sulfonamide Openeye Name: 1-butyl-N,N-dimethyl-2-[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]sulfanyl-benzimidazole-5-sulfonamide CAS Name: 1-butyl-N,N-dimethyl-2-[[5-(4-methylphenyl)-4-thieno[2,3-d]pyrimidinyl]thio]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-N,N-dimethyl-2-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylbenzimidazole-5-sulfonamide Traditional Name: 1-butyl-N,N-dimethyl-2-[[5-(p-tolyl)thieno[2,3-d]pyrimidin-4-yl]thio]benzimidazole-5-sulfonamide Formula: C26H27N5O2S3 MolecularWeight: 537.71988

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SC3=NC=NC4=C3C(=CS4)C5=CC=C(C=C5)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(C)C)N=C1SC3=NC=NC4=C3C(=CS4)C5=CC=C(C=C5)C

InChI

InChI=1S/C26H27N5O2S3/c1-5-6-13-31-22-12-11-19(36(32,33)30(3)4)14-21(22)29-26(31)35-25-23-20(15-34-24(23)27-16-28-25)18-9-7-17(2)8-10-18/h7-12,14-16H,5-6,13H2,1-4H3