2-[(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-(3-pyrazol-1-ylpropyl)ethanamide

Systemtic Name: 2-[(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-(3-pyrazol-1-ylpropyl)ethanamide Openeye Name: 2-[[4-oxo-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methylsulfanyl]-N-(3-pyrazol-1-ylpropyl)acetamide CAS Name: 2-[(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methylthio]-N-[3-(1-pyrazolyl)propyl]acetamide IUPAC Name: 2-[(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)methylsulfanyl]-N-(3-pyrazol-1-ylpropyl)acetamide Traditional Name: 2-[[4-keto-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]methylthio]-N-(3-pyrazol-1-ylpropyl)acetamide Formula: C19H19N5O2S3 MolecularWeight: 445.58146

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN(N=C1)CCCNC(=O)CSCC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2

Isomeric SMILES

C1=CN(N=C1)CCCNC(=O)CSCC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2

InChI

InChI=1S/C19H19N5O2S3/c25-16(20-5-2-7-24-8-3-6-21-24)12-27-11-15-22-18(26)17-13(10-29-19(17)23-15)14-4-1-9-28-14/h1,3-4,6,8-10H,2,5,7,11-12H2,(H,20,25)(H,22,23,26)