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

Systemtic Name: N-[2-[2-(3-methylbutylamino)-2-oxidanylidene-ethyl]sulfanyl-4-oxidanylidene-thieno[3,2-d]pyrimidin-3-yl]benzamide Openeye Name: N-[2-[2-(isopentylamino)-2-oxo-ethyl]sulfanyl-4-oxo-thieno[3,2-d]pyrimidin-3-yl]benzamide CAS Name: N-[2-[[2-(3-methylbutylamino)-2-oxoethyl]thio]-4-oxo-3-thieno[3,2-d]pyrimidinyl]benzamide IUPAC Name: N-[2-[2-(3-methylbutylamino)-2-oxoethyl]sulfanyl-4-oxothieno[3,2-d]pyrimidin-3-yl]benzamide Traditional Name: N-[2-[[2-(isoamylamino)-2-keto-ethyl]thio]-4-keto-thieno[3,2-d]pyrimidin-3-yl]benzamide Formula: C20H22N4O3S2 MolecularWeight: 430.54368

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H22N4O3S2/c1-13(2)8-10-21-16(25)12-29-20-22-15-9-11-28-17(15)19(27)24(20)23-18(26)14-6-4-3-5-7-14/h3-7,9,11,13H,8,10,12H2,1-2H3,(H,21,25)(H,23,26)