N-(3-methylbutyl)-2-(3-methyl-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-methylbutyl)-2-(3-methyl-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-ethanamide Openeye Name: N-isopentyl-2-[3-methyl-4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-acetamide CAS Name: N-(3-methylbutyl)-2-[(3-methyl-4-oxo-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl)thio]acetamide IUPAC Name: N-(3-methylbutyl)-2-(3-methyl-4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylacetamide Traditional Name: N-isoamyl-2-[[4-keto-3-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]thio]acetamide Formula: C18H21N3O2S3 MolecularWeight: 407.57324

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)CSC1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1C

Isomeric SMILES

CC(C)CCNC(=O)CSC1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1C

InChI

InChI=1S/C18H21N3O2S3/c1-11(2)6-7-19-14(22)10-26-18-20-16-15(17(23)21(18)3)12(9-25-16)13-5-4-8-24-13/h4-5,8-9,11H,6-7,10H2,1-3H3,(H,19,22)