4-[2-[(5,6-dimethyl-2-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)amino]ethyl]benzenesulfonamide

Systemtic Name: 4-[2-[(5,6-dimethyl-2-thiophen-2-yl-thieno[2,3-d]pyrimidin-4-yl)amino]ethyl]benzenesulfonamide Openeye Name: 4-[2-[[5,6-dimethyl-2-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethyl]benzenesulfonamide CAS Name: 4-[2-[(5,6-dimethyl-2-thiophen-2-yl-4-thieno[2,3-d]pyrimidinyl)amino]ethyl]benzenesulfonamide IUPAC Name: 4-[2-[(5,6-dimethyl-2-thiophen-2-ylthieno[2,3-d]pyrimidin-4-yl)amino]ethyl]benzenesulfonamide Traditional Name: 4-[2-[[5,6-dimethyl-2-(2-thienyl)thieno[2,3-d]pyrimidin-4-yl]amino]ethyl]benzenesulfonamide Formula: C20H20N4O2S3 MolecularWeight: 444.5934

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)NCCC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CS4)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)NCCC3=CC=C(C=C3)S(=O)(=O)N)C4=CC=CS4)C

InChI

InChI=1S/C20H20N4O2S3/c1-12-13(2)28-20-17(12)19(23-18(24-20)16-4-3-11-27-16)22-10-9-14-5-7-15(8-6-14)29(21,25)26/h3-8,11H,9-10H2,1-2H3,(H2,21,25,26)(H,22,23,24)