3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]propanamide

Systemtic Name: 3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]propanamide Openeye Name: 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide CAS Name: N-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: 3-(4-oxothieno[2,3-d]pyrimidin-3-yl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide Traditional Name: 3-(4-ketothieno[2,3-d]pyrimidin-3-yl)-N-[4-(pyrrolidine-1-carbonyl)benzyl]propionamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)CCN3C=NC4=C(C3=O)C=CS4

Isomeric SMILES

C1CCN(C1)C(=O)C2=CC=C(C=C2)CNC(=O)CCN3C=NC4=C(C3=O)C=CS4

InChI

InChI=1S/C21H22N4O3S/c26-18(7-11-25-14-23-19-17(21(25)28)8-12-29-19)22-13-15-3-5-16(6-4-15)20(27)24-9-1-2-10-24/h3-6,8,12,14H,1-2,7,9-11,13H2,(H,22,26)