2-[1-(cyclohexylamino)-1-oxidanylidene-butan-2-yl]sulfanyl-N,N,5-trimethyl-4-oxidanylidene-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 2-[1-(cyclohexylamino)-1-oxidanylidene-butan-2-yl]sulfanyl-N,N,5-trimethyl-4-oxidanylidene-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 2-[1-(cyclohexylcarbamoyl)propylsulfanyl]-N,N,5-trimethyl-4-oxo-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 2-[[1-(cyclohexylamino)-1-oxobutan-2-yl]thio]-N,N,5-trimethyl-4-oxo-3-phenethyl-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 2-[1-(cyclohexylamino)-1-oxobutan-2-yl]sulfanyl-N,N,5-trimethyl-4-oxo-3-phenethylthieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 2-[1-(cyclohexylcarbamoyl)propylthio]-4-keto-N,N,5-trimethyl-3-phenethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C28H36N4O3S2 MolecularWeight: 540.74044

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1CCCCC1)SC2=NC3=C(C(=C(S3)C(=O)N(C)C)C)C(=O)N2CCC4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)NC1CCCCC1)SC2=NC3=C(C(=C(S3)C(=O)N(C)C)C)C(=O)N2CCC4=CC=CC=C4

InChI

InChI=1S/C28H36N4O3S2/c1-5-21(24(33)29-20-14-10-7-11-15-20)36-28-30-25-22(18(2)23(37-25)27(35)31(3)4)26(34)32(28)17-16-19-12-8-6-9-13-19/h6,8-9,12-13,20-21H,5,7,10-11,14-17H2,1-4H3,(H,29,33)