(phenylmethyl) 2-azanyl-3-methyl-4-oxidanylidene-7a-thiophen-2-yl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidine-6-carboxylate

Systemtic Name: (phenylmethyl) 2-azanyl-3-methyl-4-oxidanylidene-7a-thiophen-2-yl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidine-6-carboxylate Openeye Name: benzyl 2-amino-3-methyl-4-oxo-7a-(2-thienyl)-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidine-6-carboxylate CAS Name: 2-amino-3-methyl-4-oxo-7a-thiophen-2-yl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidine-6-carboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-amino-3-methyl-4-oxo-7a-thiophen-2-yl-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidine-6-carboxylate Traditional Name: 2-amino-4-keto-3-methyl-7a-(2-thienyl)-5,7-dihydro-4aH-pyrrolo[3,4-d]pyrimidine-6-carboxylic acid benzyl ester Formula: C19H20N4O3S MolecularWeight: 384.4521

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2CN(CC2(N=C1N)C3=CC=CS3)C(=O)OCC4=CC=CC=C4

Isomeric SMILES

CN1C(=O)C2CN(CC2(N=C1N)C3=CC=CS3)C(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C19H20N4O3S/c1-22-16(24)14-10-23(18(25)26-11-13-6-3-2-4-7-13)12-19(14,21-17(22)20)15-8-5-9-27-15/h2-9,14H,10-12H2,1H3,(H2,20,21)