phenethyl 3-[2-[(3-aminocarbonyl-5-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate

Systemtic Name: phenethyl 3-[2-[(3-aminocarbonyl-5-phenyl-thiophen-2-yl)amino]-2-oxidanylidene-ethyl]-5-methyl-4-oxidanylidene-thieno[2,3-d]pyrimidine-6-carboxylate Openeye Name: phenethyl 3-[2-[(3-carbamoyl-5-phenyl-2-thienyl)amino]-2-oxo-ethyl]-5-methyl-4-oxo-thieno[2,3-d]pyrimidine-6-carboxylate CAS Name: 3-[2-[(3-carbamoyl-5-phenyl-2-thiophenyl)amino]-2-oxoethyl]-5-methyl-4-oxo-6-thieno[2,3-d]pyrimidinecarboxylic acid phenethyl ester IUPAC Name: phenethyl 3-[2-[(3-carbamoyl-5-phenylthiophen-2-yl)amino]-2-oxoethyl]-5-methyl-4-oxothieno[2,3-d]pyrimidine-6-carboxylate Traditional Name: 3-[2-[(3-carbamoyl-5-phenyl-2-thienyl)amino]-2-keto-ethyl]-4-keto-5-methyl-thieno[2,3-d]pyrimidine-6-carboxylic acid phenethyl ester Formula: C29H24N4O5S2 MolecularWeight: 572.65466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N)C(=O)OCCC5=CC=CC=C5

Isomeric SMILES

CC1=C(SC2=C1C(=O)N(C=N2)CC(=O)NC3=C(C=C(S3)C4=CC=CC=C4)C(=O)N)C(=O)OCCC5=CC=CC=C5

InChI

InChI=1S/C29H24N4O5S2/c1-17-23-27(40-24(17)29(37)38-13-12-18-8-4-2-5-9-18)31-16-33(28(23)36)15-22(34)32-26-20(25(30)35)14-21(39-26)19-10-6-3-7-11-19/h2-11,14,16H,12-13,15H2,1H3,(H2,30,35)(H,32,34)