N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide

Systemtic Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-3-(4-oxidanylidenethieno[2,3-d]pyrimidin-3-yl)propanamide Openeye Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide CAS Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-3-(4-oxo-3-thieno[2,3-d]pyrimidinyl)propanamide IUPAC Name: N-[2-(1H-indol-3-yl)-2-phenylethyl]-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide Traditional Name: N-[2-(1H-indol-3-yl)-2-phenyl-ethyl]-3-(4-ketothieno[2,3-d]pyrimidin-3-yl)propionamide Formula: C25H22N4O2S MolecularWeight: 442.53278

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CNC(=O)CCN2C=NC3=C(C2=O)C=CS3)C4=CNC5=CC=CC=C54

Isomeric SMILES

C1=CC=C(C=C1)C(CNC(=O)CCN2C=NC3=C(C2=O)C=CS3)C4=CNC5=CC=CC=C54

InChI

InChI=1S/C25H22N4O2S/c30-23(10-12-29-16-28-24-19(25(29)31)11-13-32-24)27-14-20(17-6-2-1-3-7-17)21-15-26-22-9-5-4-8-18(21)22/h1-9,11,13,15-16,20,26H,10,12,14H2,(H,27,30)