3-ethyl-2-[2-(4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxidanylidene-ethyl]sulfanyl-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-ethyl-2-[2-(4-methyl-2-oxidanylidene-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxidanylidene-ethyl]sulfanyl-thieno[3,2-d]pyrimidin-4-one Openeye Name: 3-ethyl-2-[2-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxo-ethyl]sulfanyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 3-ethyl-2-[[2-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxoethyl]thio]-4-thieno[3,2-d]pyrimidinone IUPAC Name: 3-ethyl-2-[2-(4-methyl-2-oxo-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)-2-oxoethyl]sulfanylthieno[3,2-d]pyrimidin-4-one Traditional Name: 3-ethyl-2-[[2-keto-2-(2-keto-4-methyl-3,4-dihydro-1H-1,5-benzodiazepin-5-yl)ethyl]thio]thieno[3,2-d]pyrimidin-4-one Formula: C20H20N4O3S2 MolecularWeight: 428.5278

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)N3C(CC(=O)NC4=CC=CC=C43)C

Isomeric SMILES

CCN1C(=O)C2=C(C=CS2)N=C1SCC(=O)N3C(CC(=O)NC4=CC=CC=C43)C

InChI

InChI=1S/C20H20N4O3S2/c1-3-23-19(27)18-14(8-9-28-18)22-20(23)29-11-17(26)24-12(2)10-16(25)21-13-6-4-5-7-15(13)24/h4-9,12H,3,10-11H2,1-2H3,(H,21,25)