N-(4-pyrrolidin-1-ylsulfonylphenyl)-2-(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-propanamide

Systemtic Name: N-(4-pyrrolidin-1-ylsulfonylphenyl)-2-(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-propanamide Openeye Name: N-(4-pyrrolidin-1-ylsulfonylphenyl)-2-(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-propanamide CAS Name: N-[4-(1-pyrrolidinylsulfonyl)phenyl]-2-[(2,5,6-trimethyl-4-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: N-(4-pyrrolidin-1-ylsulfonylphenyl)-2-(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylpropanamide Traditional Name: N-(4-pyrrolidinosulfonylphenyl)-2-[(2,5,6-trimethylthieno[2,3-d]pyrimidin-4-yl)thio]propionamide Formula: C22H26N4O3S3 MolecularWeight: 490.66184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC(=N2)C)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC(=N2)C)SC(C)C(=O)NC3=CC=C(C=C3)S(=O)(=O)N4CCCC4)C

InChI

InChI=1S/C22H26N4O3S3/c1-13-14(2)30-21-19(13)22(24-16(4)23-21)31-15(3)20(27)25-17-7-9-18(10-8-17)32(28,29)26-11-5-6-12-26/h7-10,15H,5-6,11-12H2,1-4H3,(H,25,27)