1-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2-thieno[2,3-d]pyrimidin-4-yloxy-ethanone

Systemtic Name: 1-[2,5-dimethyl-1-(phenylmethyl)pyrrol-3-yl]-2-thieno[2,3-d]pyrimidin-4-yloxy-ethanone Openeye Name: 1-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)-2-thieno[2,3-d]pyrimidin-4-yloxy-ethanone CAS Name: 1-[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]-2-(4-thieno[2,3-d]pyrimidinyloxy)ethanone IUPAC Name: 1-(1-benzyl-2,5-dimethylpyrrol-3-yl)-2-thieno[2,3-d]pyrimidin-4-yloxyethanone Traditional Name: 1-(1-benzyl-2,5-dimethyl-pyrrol-3-yl)-2-thieno[2,3-d]pyrimidin-4-yloxy-ethanone Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)COC3=C4C=CSC4=NC=N3

Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CC=C2)C)C(=O)COC3=C4C=CSC4=NC=N3

InChI

InChI=1S/C21H19N3O2S/c1-14-10-18(15(2)24(14)11-16-6-4-3-5-7-16)19(25)12-26-20-17-8-9-27-21(17)23-13-22-20/h3-10,13H,11-12H2,1-2H3