[5-azanyl-4-(phenylmethylsulfanyl)-2-pyrrolidin-1-yl-thieno[2,3-d]pyrimidin-6-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [5-azanyl-4-(phenylmethylsulfanyl)-2-pyrrolidin-1-yl-thieno[2,3-d]pyrimidin-6-yl]-pyrrolidin-1-yl-methanone Openeye Name: (5-amino-4-benzylsulfanyl-2-pyrrolidin-1-yl-thieno[2,3-d]pyrimidin-6-yl)-pyrrolidin-1-yl-methanone CAS Name: [5-amino-4-(phenylmethylthio)-2-(1-pyrrolidinyl)-6-thieno[2,3-d]pyrimidinyl]-(1-pyrrolidinyl)methanone IUPAC Name: (5-amino-4-benzylsulfanyl-2-pyrrolidin-1-ylthieno[2,3-d]pyrimidin-6-yl)-pyrrolidin-1-ylmethanone Traditional Name: [5-amino-4-(benzylthio)-2-pyrrolidino-thieno[2,3-d]pyrimidin-6-yl]-pyrrolidino-methanone Formula: C22H25N5OS2 MolecularWeight: 439.5968

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=NC3=C(C(=C(S3)C(=O)N4CCCC4)N)C(=N2)SCC5=CC=CC=C5

Isomeric SMILES

C1CCN(C1)C2=NC3=C(C(=C(S3)C(=O)N4CCCC4)N)C(=N2)SCC5=CC=CC=C5

InChI

InChI=1S/C22H25N5OS2/c23-17-16-19(29-14-15-8-2-1-3-9-15)24-22(27-12-6-7-13-27)25-20(16)30-18(17)21(28)26-10-4-5-11-26/h1-3,8-9H,4-7,10-14,23H2