N-(4-tert-butylphenyl)-2-(4-oxidanylidene-3-phenethyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide

Systemtic Name: N-(4-tert-butylphenyl)-2-(4-oxidanylidene-3-phenethyl-5-thiophen-2-yl-thieno[2,3-d]pyrimidin-2-yl)sulfanyl-propanamide Openeye Name: N-(4-tert-butylphenyl)-2-[4-oxo-3-phenethyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]sulfanyl-propanamide CAS Name: N-(4-tert-butylphenyl)-2-[(4-oxo-3-phenethyl-5-thiophen-2-yl-2-thieno[2,3-d]pyrimidinyl)thio]propanamide IUPAC Name: N-(4-tert-butylphenyl)-2-(4-oxo-3-phenethyl-5-thiophen-2-ylthieno[2,3-d]pyrimidin-2-yl)sulfanylpropanamide Traditional Name: N-(4-tert-butylphenyl)-2-[[4-keto-3-phenethyl-5-(2-thienyl)thieno[2,3-d]pyrimidin-2-yl]thio]propionamide Formula: C31H31N3O2S3 MolecularWeight: 573.79174

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(C)(C)C)SC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CCC5=CC=CC=C5

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(C)(C)C)SC2=NC3=C(C(=CS3)C4=CC=CS4)C(=O)N2CCC5=CC=CC=C5

InChI

InChI=1S/C31H31N3O2S3/c1-20(27(35)32-23-14-12-22(13-15-23)31(2,3)4)39-30-33-28-26(24(19-38-28)25-11-8-18-37-25)29(36)34(30)17-16-21-9-6-5-7-10-21/h5-15,18-20H,16-17H2,1-4H3,(H,32,35)