3-[5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-N-(6-pyrrolidin-1-ylpyridin-3-yl)propanamide

Systemtic Name: 3-[5-(4-methylphenyl)-4-oxidanylidene-thieno[2,3-d]pyrimidin-3-yl]-N-(6-pyrrolidin-1-ylpyridin-3-yl)propanamide Openeye Name: 3-[4-oxo-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]-N-(6-pyrrolidin-1-yl-3-pyridyl)propanamide CAS Name: 3-[5-(4-methylphenyl)-4-oxo-3-thieno[2,3-d]pyrimidinyl]-N-[6-(1-pyrrolidinyl)-3-pyridinyl]propanamide IUPAC Name: 3-[5-(4-methylphenyl)-4-oxothieno[2,3-d]pyrimidin-3-yl]-N-(6-pyrrolidin-1-ylpyridin-3-yl)propanamide Traditional Name: 3-[4-keto-5-(p-tolyl)thieno[2,3-d]pyrimidin-3-yl]-N-(6-pyrrolidino-3-pyridyl)propionamide Formula: C25H25N5O2S MolecularWeight: 459.5633

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CCC(=O)NC4=CN=C(C=C4)N5CCCC5

Isomeric SMILES

CC1=CC=C(C=C1)C2=CSC3=C2C(=O)N(C=N3)CCC(=O)NC4=CN=C(C=C4)N5CCCC5

InChI

InChI=1S/C25H25N5O2S/c1-17-4-6-18(7-5-17)20-15-33-24-23(20)25(32)30(16-27-24)13-10-22(31)28-19-8-9-21(26-14-19)29-11-2-3-12-29/h4-9,14-16H,2-3,10-13H2,1H3,(H,28,31)