N-[2-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]benzamide

Systemtic Name: N-[2-[2-(butan-2-ylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]benzamide Openeye Name: N-[4-oxo-2-[2-oxo-2-(sec-butylamino)ethyl]sulfanyl-thieno[3,2-d]pyrimidin-3-yl]benzamide CAS Name: N-[2-[[2-(butan-2-ylamino)-2-oxoethyl]thio]-4-oxo-3-thieno[3,2-d]pyrimidinyl]benzamide IUPAC Name: N-[2-[2-(butan-2-ylamino)-2-oxoethyl]sulfanyl-4-oxothieno[3,2-d]pyrimidin-3-yl]benzamide Traditional Name: N-[4-keto-2-[[2-keto-2-(sec-butylamino)ethyl]thio]thieno[3,2-d]pyrimidin-3-yl]benzamide Formula: C19H20N4O3S2 MolecularWeight: 416.5171

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)CSC1=NC2=C(C(=O)N1NC(=O)C3=CC=CC=C3)SC=C2

Isomeric SMILES

CCC(C)NC(=O)CSC1=NC2=C(C(=O)N1NC(=O)C3=CC=CC=C3)SC=C2

InChI

InChI=1S/C19H20N4O3S2/c1-3-12(2)20-15(24)11-28-19-21-14-9-10-27-16(14)18(26)23(19)22-17(25)13-7-5-4-6-8-13/h4-10,12H,3,11H2,1-2H3,(H,20,24)(H,22,25)