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

Systemtic Name: 2-[3-(3-methylbutyl)-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(methylcarbamoyl)ethanamide Openeye Name: 2-[3-isopentyl-4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(methylcarbamoyl)acetamide CAS Name: 2-[[3-(3-methylbutyl)-4-oxo-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl]thio]-N-(methylcarbamoyl)acetamide IUPAC Name: 2-[3-(3-methylbutyl)-4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl]sulfanyl-N-(methylcarbamoyl)acetamide Traditional Name: 2-[[3-isoamyl-4-keto-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]thio]-N-(methylcarbamoyl)acetamide Formula: C19H22N4O3S3 MolecularWeight: 450.59798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(N=C1SCC(=O)NC(=O)NC)SC=C2C3=CC=CS3

Isomeric SMILES

CC(C)CCN1C(=O)C2=C(N=C1SCC(=O)NC(=O)NC)SC=C2C3=CC=CS3

InChI

InChI=1S/C19H22N4O3S3/c1-11(2)6-7-23-17(25)15-12(13-5-4-8-27-13)9-28-16(15)22-19(23)29-10-14(24)21-18(26)20-3/h4-5,8-9,11H,6-7,10H2,1-3H3,(H2,20,21,24,26)