4-[[(10bR)-1,10b-dihydropyrazolo[1,5-c]quinazolin-5-yl]sulfanylmethyl]benzenecarbonitrile

Systemtic Name: 4-[[(10bR)-1,10b-dihydropyrazolo[1,5-c]quinazolin-5-yl]sulfanylmethyl]benzenecarbonitrile Openeye Name: 4-[[(10bR)-1,10b-dihydropyrazolo[1,5-c]quinazolin-5-yl]sulfanylmethyl]benzonitrile CAS Name: 4-[[[(10bR)-1,10b-dihydropyrazolo[1,5-c]quinazolin-5-yl]thio]methyl]benzonitrile IUPAC Name: 4-[[(10bR)-1,10b-dihydropyrazolo[1,5-c]quinazolin-5-yl]sulfanylmethyl]benzonitrile Traditional Name: 4-[[[(10bR)-1,10b-dihydropyrazolo[1,5-c]quinazolin-5-yl]thio]methyl]benzonitrile Formula: C18H14N4S MolecularWeight: 318.39556

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Descriptors Computed from Structure

Canonical SMILES:

C1C=NN2C1C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1C=NN2[C@H]1C3=CC=CC=C3N=C2SCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C18H14N4S/c19-11-13-5-7-14(8-6-13)12-23-18-21-16-4-2-1-3-15(16)17-9-10-20-22(17)18/h1-8,10,17H,9,12H2/t17-/m1/s1