3-[2-(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanylethanoylamino]-N-methyl-benzamide

Systemtic Name: 3-[2-(4-azanylthieno[2,3-d]pyrimidin-2-yl)sulfanylethanoylamino]-N-methyl-benzamide Openeye Name: 3-[[2-(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]-N-methyl-benzamide CAS Name: 3-[[2-[(4-amino-2-thieno[2,3-d]pyrimidinyl)thio]-1-oxoethyl]amino]-N-methylbenzamide IUPAC Name: 3-[[2-(4-aminothieno[2,3-d]pyrimidin-2-yl)sulfanylacetyl]amino]-N-methylbenzamide Traditional Name: 3-[[2-[(4-aminothieno[2,3-d]pyrimidin-2-yl)thio]acetyl]amino]-N-methyl-benzamide Formula: C16H15N5O2S2 MolecularWeight: 373.4526

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=C3C=CSC3=N2)N

Isomeric SMILES

CNC(=O)C1=CC(=CC=C1)NC(=O)CSC2=NC(=C3C=CSC3=N2)N

InChI

InChI=1S/C16H15N5O2S2/c1-18-14(23)9-3-2-4-10(7-9)19-12(22)8-25-16-20-13(17)11-5-6-24-15(11)21-16/h2-7H,8H2,1H3,(H,18,23)(H,19,22)(H2,17,20,21)