3-[2-(4-chlorophenyl)ethyl]-2-[1-[(3-methoxyphenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanyl-N,N,5-trimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide

Systemtic Name: 3-[2-(4-chlorophenyl)ethyl]-2-[1-[(3-methoxyphenyl)amino]-1-oxidanylidene-butan-2-yl]sulfanyl-N,N,5-trimethyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxamide Openeye Name: 3-[2-(4-chlorophenyl)ethyl]-2-[1-[(3-methoxyphenyl)carbamoyl]propylsulfanyl]-N,N,5-trimethyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxamide CAS Name: 3-[2-(4-chlorophenyl)ethyl]-2-[[1-(3-methoxyanilino)-1-oxobutan-2-yl]thio]-N,N,5-trimethyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxamide IUPAC Name: 3-[2-(4-chlorophenyl)ethyl]-2-[1-(3-methoxyanilino)-1-oxobutan-2-yl]sulfanyl-N,N,5-trimethyl-4-oxothieno[2,3-d]pyrimidine-6-carboxamide Traditional Name: 3-[2-(4-chlorophenyl)ethyl]-4-keto-2-[1-[(3-methoxyphenyl)carbamoyl]propylthio]-N,N,5-trimethyl-thieno[2,3-d]pyrimidine-6-carboxamide Formula: C29H31ClN4O4S2 MolecularWeight: 599.16384

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC(=CC=C1)OC)SC2=NC3=C(C(=C(S3)C(=O)N(C)C)C)C(=O)N2CCC4=CC=C(C=C4)Cl

Isomeric SMILES

CCC(C(=O)NC1=CC(=CC=C1)OC)SC2=NC3=C(C(=C(S3)C(=O)N(C)C)C)C(=O)N2CCC4=CC=C(C=C4)Cl

InChI

InChI=1S/C29H31ClN4O4S2/c1-6-22(25(35)31-20-8-7-9-21(16-20)38-5)39-29-32-26-23(17(2)24(40-26)28(37)33(3)4)27(36)34(29)15-14-18-10-12-19(30)13-11-18/h7-13,16,22H,6,14-15H2,1-5H3,(H,31,35)