ethyl 5-(2-methylsulfanylpyrimidin-4-yl)-3-(2-naphthalen-2-ylethanoylamino)-4,6-dihydropyrrolo[3,4-c]pyrazole-1-carboxylate

Systemtic Name: ethyl 5-(2-methylsulfanylpyrimidin-4-yl)-3-(2-naphthalen-2-ylethanoylamino)-4,6-dihydropyrrolo[3,4-c]pyrazole-1-carboxylate Openeye Name: ethyl 5-(2-methylsulfanylpyrimidin-4-yl)-3-[[2-(2-naphthyl)acetyl]amino]-4,6-dihydropyrrolo[3,4-c]pyrazole-1-carboxylate CAS Name: 5-[2-(methylthio)-4-pyrimidinyl]-3-[[2-(2-naphthalenyl)-1-oxoethyl]amino]-4,6-dihydropyrrolo[3,4-c]pyrazole-1-carboxylic acid ethyl ester IUPAC Name: ethyl 5-(2-methylsulfanylpyrimidin-4-yl)-3-[(2-naphthalen-2-ylacetyl)amino]-4,6-dihydropyrrolo[3,4-c]pyrazole-1-carboxylate Traditional Name: 5-[2-(methylthio)pyrimidin-4-yl]-3-[[2-(2-naphthyl)acetyl]amino]-4,6-dihydropyrrolo[3,4-c]pyrazole-1-carboxylic acid ethyl ester Formula: C25H24N6O3S MolecularWeight: 488.56146

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1C2=C(CN(C2)C3=NC(=NC=C3)SC)C(=N1)NC(=O)CC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CCOC(=O)N1C2=C(CN(C2)C3=NC(=NC=C3)SC)C(=N1)NC(=O)CC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C25H24N6O3S/c1-3-34-25(33)31-20-15-30(21-10-11-26-24(27-21)35-2)14-19(20)23(29-31)28-22(32)13-16-8-9-17-6-4-5-7-18(17)12-16/h4-12H,3,13-15H2,1-2H3,(H,28,29,32)