N-(3-methylbutyl)-2-(4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-methylbutyl)-2-(4-oxidanylidene-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-isopentyl-2-(4-oxo-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-acetamide CAS Name: N-(3-methylbutyl)-2-[(4-oxo-3-phenyl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(3-methylbutyl)-2-(4-oxo-3-phenylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N-isoamyl-2-[(4-keto-3-phenyl-thieno[2,3-d]pyrimidin-2-yl)thio]acetamide Formula: C19H21N3O2S2 MolecularWeight: 387.51894

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CSC1=NC2=C(C=CS2)C(=O)N1C3=CC=CC=C3

Isomeric SMILES

CC(C)CCNC(=O)CSC1=NC2=C(C=CS2)C(=O)N1C3=CC=CC=C3

InChI

InChI=1S/C19H21N3O2S2/c1-13(2)8-10-20-16(23)12-26-19-21-17-15(9-11-25-17)18(24)22(19)14-6-4-3-5-7-14/h3-7,9,11,13H,8,10,12H2,1-2H3,(H,20,23)