methyl 4-[[(10bS)-1,10b-dihydropyrazolo[1,5-c]quinazolin-5-yl]sulfanylmethyl]benzoate

Systemtic Name: methyl 4-[[(10bS)-1,10b-dihydropyrazolo[1,5-c]quinazolin-5-yl]sulfanylmethyl]benzoate Openeye Name: methyl 4-[[(10bS)-1,10b-dihydropyrazolo[1,5-c]quinazolin-5-yl]sulfanylmethyl]benzoate CAS Name: 4-[[[(10bS)-1,10b-dihydropyrazolo[1,5-c]quinazolin-5-yl]thio]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(10bS)-1,10b-dihydropyrazolo[1,5-c]quinazolin-5-yl]sulfanylmethyl]benzoate Traditional Name: 4-[[[(10bS)-1,10b-dihydropyrazolo[1,5-c]quinazolin-5-yl]thio]methyl]benzoic acid methyl ester Formula: C19H17N3O2S MolecularWeight: 351.42218

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3C4N2N=CC4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CSC2=NC3=CC=CC=C3[C@H]4N2N=CC4

InChI

InChI=1S/C19H17N3O2S/c1-24-18(23)14-8-6-13(7-9-14)12-25-19-21-16-5-3-2-4-15(16)17-10-11-20-22(17)19/h2-9,11,17H,10,12H2,1H3/t17-/m0/s1