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

Systemtic Name: 2-(3-methyl-4-oxidanylidene-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-N-(phenylmethyl)propanamide Openeye Name: N-benzyl-2-[3-methyl-4-oxo-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-propanamide CAS Name: 2-[(3-methyl-4-oxo-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl)thio]-N-(phenylmethyl)propanamide IUPAC Name: N-benzyl-2-(3-methyl-4-oxo-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: N-benzyl-2-[[4-keto-3-methyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]thio]propionamide Formula: C21H19N3O2S3 MolecularWeight: 441.58946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC1=CC=CC=C1)SC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2C

Isomeric SMILES

CC(C(=O)NCC1=CC=CC=C1)SC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2C

InChI

InChI=1S/C21H19N3O2S3/c1-13(18(25)22-11-14-7-4-3-5-8-14)29-21-23-19-17(20(26)24(21)2)15(12-28-19)16-9-6-10-27-16/h3-10,12-13H,11H2,1-2H3,(H,22,25)