2-[4-azanyl-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[4-azanyl-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(phenylmethyl)ethanamide Openeye Name: 2-[4-amino-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-benzyl-acetamide CAS Name: 2-[[4-amino-5-(4-methoxyphenyl)-2-thieno[2,3-d]pyrimidinyl]thio]-N-(phenylmethyl)acetamide IUPAC Name: 2-[4-amino-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-benzylacetamide Traditional Name: 2-[[4-amino-5-(4-methoxyphenyl)thieno[2,3-d]pyrimidin-2-yl]thio]-N-benzyl-acetamide Formula: C22H20N4O2S2 MolecularWeight: 436.5498

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC3=NC(=NC(=C23)N)SCC(=O)NCC4=CC=CC=C4

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC3=NC(=NC(=C23)N)SCC(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C22H20N4O2S2/c1-28-16-9-7-15(8-10-16)17-12-29-21-19(17)20(23)25-22(26-21)30-13-18(27)24-11-14-5-3-2-4-6-14/h2-10,12H,11,13H2,1H3,(H,24,27)(H2,23,25,26)