ethyl 5-propan-2-yl-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)thiophene-3-carboxylate

Systemtic Name: ethyl 5-propan-2-yl-2-(2-thieno[2,3-d]pyrimidin-4-ylsulfanylethanoylamino)thiophene-3-carboxylate Openeye Name: ethyl 5-isopropyl-2-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]thiophene-3-carboxylate CAS Name: 2-[[1-oxo-2-(4-thieno[2,3-d]pyrimidinylthio)ethyl]amino]-5-propan-2-yl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-propan-2-yl-2-[(2-thieno[2,3-d]pyrimidin-4-ylsulfanylacetyl)amino]thiophene-3-carboxylate Traditional Name: 5-isopropyl-2-[[2-(thieno[2,3-d]pyrimidin-4-ylthio)acetyl]amino]thiophene-3-carboxylic acid ethyl ester Formula: C18H19N3O3S3 MolecularWeight: 421.55676

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)CSC2=NC=NC3=C2C=CS3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C(C)C)NC(=O)CSC2=NC=NC3=C2C=CS3

InChI

InChI=1S/C18H19N3O3S3/c1-4-24-18(23)12-7-13(10(2)3)27-17(12)21-14(22)8-26-16-11-5-6-25-15(11)19-9-20-16/h5-7,9-10H,4,8H2,1-3H3,(H,21,22)