methyl 3-[[5-methyl-4-oxidanylidene-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidin-6-yl]carbonylamino]-3-phenyl-propanoate

Systemtic Name: methyl 3-[[5-methyl-4-oxidanylidene-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidin-6-yl]carbonylamino]-3-phenyl-propanoate Openeye Name: methyl 3-[(2-benzyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carbonyl)amino]-3-phenyl-propanoate CAS Name: 3-[[[5-methyl-4-oxo-2-(phenylmethyl)-3H-thieno[2,3-d]pyrimidin-6-yl]-oxomethyl]amino]-3-phenylpropanoic acid methyl ester IUPAC Name: methyl 3-[(2-benzyl-5-methyl-4-oxo-3H-thieno[2,3-d]pyrimidine-6-carbonyl)amino]-3-phenylpropanoate Traditional Name: 3-[(2-benzyl-4-keto-5-methyl-3H-thieno[2,3-d]pyrimidine-6-carbonyl)amino]-3-phenyl-propionic acid methyl ester Formula: C25H23N3O4S MolecularWeight: 461.53282

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CC3=CC=CC=C3)C(=O)NC(CC(=O)OC)C4=CC=CC=C4

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CC3=CC=CC=C3)C(=O)NC(CC(=O)OC)C4=CC=CC=C4

InChI

InChI=1S/C25H23N3O4S/c1-15-21-23(30)27-19(13-16-9-5-3-6-10-16)28-25(21)33-22(15)24(31)26-18(14-20(29)32-2)17-11-7-4-8-12-17/h3-12,18H,13-14H2,1-2H3,(H,26,31)(H,27,28,30)