4-[5,6-dimethyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]oxybenzamide

Systemtic Name: 4-[5,6-dimethyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]oxybenzamide Openeye Name: 4-[5,6-dimethyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]oxybenzamide CAS Name: 4-[[5,6-dimethyl-2-[(phenylthio)methyl]-4-thieno[2,3-d]pyrimidinyl]oxy]benzamide IUPAC Name: 4-[5,6-dimethyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]oxybenzamide Traditional Name: 4-[5,6-dimethyl-2-[(phenylthio)methyl]thieno[2,3-d]pyrimidin-4-yl]oxybenzamide Formula: C22H19N3O2S2 MolecularWeight: 421.53516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=NC(=NC(=C12)OC3=CC=C(C=C3)C(=O)N)CSC4=CC=CC=C4)C

Isomeric SMILES

CC1=C(SC2=NC(=NC(=C12)OC3=CC=C(C=C3)C(=O)N)CSC4=CC=CC=C4)C

InChI

InChI=1S/C22H19N3O2S2/c1-13-14(2)29-22-19(13)21(27-16-10-8-15(9-11-16)20(23)26)24-18(25-22)12-28-17-6-4-3-5-7-17/h3-11H,12H2,1-2H3,(H2,23,26)