6-phenyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 6-phenyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]thieno[2,3-d]pyrimidin-4-amine Openeye Name: 6-phenyl-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]thieno[2,3-d]pyrimidin-4-amine CAS Name: 6-phenyl-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 6-phenyl-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]thieno[2,3-d]pyrimidin-4-amine Traditional Name: (6-phenylthieno[2,3-d]pyrimidin-4-yl)-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]amine Formula: C21H20N4O2S3 MolecularWeight: 456.6041

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CNC3=C4C=C(SC4=NC=N3)C5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CNC3=C4C=C(SC4=NC=N3)C5=CC=CC=C5

InChI

InChI=1S/C21H20N4O2S3/c26-30(27,25-10-4-5-11-25)19-9-8-16(28-19)13-22-20-17-12-18(15-6-2-1-3-7-15)29-21(17)24-14-23-20/h1-3,6-9,12,14H,4-5,10-11,13H2,(H,22,23,24)