1-[(3R,3aS)-3-thiophen-2-yl-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl]ethanone

Systemtic Name: 1-[(3R,3aS)-3-thiophen-2-yl-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl]ethanone Openeye Name: 1-[(3R,3aS)-3-(2-thienyl)-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl]ethanone CAS Name: 1-[(3R,3aS)-3-thiophen-2-yl-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl]ethanone IUPAC Name: 1-[(3R,3aS)-3-thiophen-2-yl-3,3a,4,5-tetrahydrobenzo[g]indazol-2-yl]ethanone Traditional Name: 1-[(3R,3aS)-3-(2-thienyl)-3,3a,4,5-tetrahydrobenz[g]indazol-2-yl]ethanone Formula: C17H16N2OS MolecularWeight: 296.38674

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(C2CCC3=CC=CC=C3C2=N1)C4=CC=CS4

Isomeric SMILES

CC(=O)N1[C@H]([C@@H]2CCC3=CC=CC=C3C2=N1)C4=CC=CS4

InChI

InChI=1S/C17H16N2OS/c1-11(20)19-17(15-7-4-10-21-15)14-9-8-12-5-2-3-6-13(12)16(14)18-19/h2-7,10,14,17H,8-9H2,1H3/t14-,17-/m1/s1