1-(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)ethyl 5-[(4-methoxyphenyl)sulfamoyl]-2-methyl-benzoate

Systemtic Name: 1-(4-oxidanylidene-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)ethyl 5-[(4-methoxyphenyl)sulfamoyl]-2-methyl-benzoate Openeye Name: 1-[4-oxo-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]ethyl 5-[(4-methoxyphenyl)sulfamoyl]-2-methyl-benzoate CAS Name: 5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzoic acid 1-(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)ethyl ester IUPAC Name: 1-(4-oxo-5-thiophen-2-yl-3H-thieno[2,3-d]pyrimidin-2-yl)ethyl 5-[(4-methoxyphenyl)sulfamoyl]-2-methylbenzoate Traditional Name: 5-[(4-methoxyphenyl)sulfamoyl]-2-methyl-benzoic acid 1-[4-keto-5-(2-thienyl)-3H-thieno[2,3-d]pyrimidin-2-yl]ethyl ester Formula: C27H23N3O6S3 MolecularWeight: 581.68302

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)OC)C(=O)OC(C)C3=NC4=C(C(=CS4)C5=CC=CS5)C(=O)N3

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)NC2=CC=C(C=C2)OC)C(=O)OC(C)C3=NC4=C(C(=CS4)C5=CC=CS5)C(=O)N3

InChI

InChI=1S/C27H23N3O6S3/c1-15-6-11-19(39(33,34)30-17-7-9-18(35-3)10-8-17)13-20(15)27(32)36-16(2)24-28-25(31)23-21(14-38-26(23)29-24)22-5-4-12-37-22/h4-14,16,30H,1-3H3,(H,28,29,31)