(5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 2-(naphthalen-2-ylcarbonylamino)ethanoate

Systemtic Name: (5,6-dimethyl-4-oxidanylidene-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 2-(naphthalen-2-ylcarbonylamino)ethanoate Openeye Name: (5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 2-(naphthalene-2-carbonylamino)acetate CAS Name: 2-[[2-naphthalenyl(oxo)methyl]amino]acetic acid (5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl ester IUPAC Name: (5,6-dimethyl-4-oxo-3H-thieno[2,3-d]pyrimidin-2-yl)methyl 2-(naphthalene-2-carbonylamino)acetate Traditional Name: 2-(2-naphthoylamino)acetic acid (4-keto-5,6-dimethyl-3H-thieno[2,3-d]pyrimidin-2-yl)methyl ester Formula: C22H19N3O4S MolecularWeight: 421.46896

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)COC(=O)CNC(=O)C3=CC4=CC=CC=C4C=C3)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)COC(=O)CNC(=O)C3=CC4=CC=CC=C4C=C3)C

InChI

InChI=1S/C22H19N3O4S/c1-12-13(2)30-22-19(12)21(28)24-17(25-22)11-29-18(26)10-23-20(27)16-8-7-14-5-3-4-6-15(14)9-16/h3-9H,10-11H2,1-2H3,(H,23,27)(H,24,25,28)