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

Systemtic Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Openeye Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide CAS Name: 2-[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]benzamide IUPAC Name: 2-(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanyl-N-(4-pyrrolidin-1-ylsulfonylphenyl)benzamide Traditional Name: 2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]-N-(4-pyrrolidinosulfonylphenyl)benzamide Formula: C25H24N4O3S3 MolecularWeight: 524.67806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SC3=CC=CC=C3C(=O)NC4=CC=C(C=C4)S(=O)(=O)N5CCCC5)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SC3=CC=CC=C3C(=O)NC4=CC=C(C=C4)S(=O)(=O)N5CCCC5)C

InChI

InChI=1S/C25H24N4O3S3/c1-16-17(2)33-24-22(16)25(27-15-26-24)34-21-8-4-3-7-20(21)23(30)28-18-9-11-19(12-10-18)35(31,32)29-13-5-6-14-29/h3-4,7-12,15H,5-6,13-14H2,1-2H3,(H,28,30)