N-cyclohexyl-5-methyl-4-oxidanylidene-2-phenacylsulfanyl-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: N-cyclohexyl-5-methyl-4-oxidanylidene-2-phenacylsulfanyl-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: N-cyclohexyl-5-methyl-4-oxo-2-phenacylsulfanyl-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: N-cyclohexyl-5-methyl-4-oxo-2-(phenacylthio)-3-phenethyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: N-cyclohexyl-5-methyl-4-oxo-2-phenacylsulfanyl-3-phenethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: N-cyclohexyl-4-keto-5-methyl-2-(phenacylthio)-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C30H31N3O3S2 MolecularWeight: 545.71544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)C3=CC=CC=C3)CCC4=CC=CC=C4)C(=O)NC5CCCCC5

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C(=N2)SCC(=O)C3=CC=CC=C3)CCC4=CC=CC=C4)C(=O)NC5CCCCC5

InChI

InChI=1S/C30H31N3O3S2/c1-20-25-28(38-26(20)27(35)31-23-15-9-4-10-16-23)32-30(37-19-24(34)22-13-7-3-8-14-22)33(29(25)36)18-17-21-11-5-2-6-12-21/h2-3,5-8,11-14,23H,4,9-10,15-19H2,1H3,(H,31,35)