(2R)-N-aminocarbonyl-2-[3-(3-methylbutyl)-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl]sulfanyl-propanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)C2=C(N=C1SC(C)C(=O)NC(=O)N)SC=C2C3=CC=CS3

Isomeric SMILES

C[C@H](C(=O)NC(=O)N)SC1=NC2=C(C(=CS2)C3=CC=CS3)C(=O)N1CCC(C)C

InChI

InChI=1S/C19H22N4O3S3/c1-10(2)6-7-23-17(25)14-12(13-5-4-8-27-13)9-28-16(14)22-19(23)29-11(3)15(24)21-18(20)26/h4-5,8-11H,6-7H2,1-3H3,(H3,20,21,24,26)/t11-/m1/s1