2,1,3-benzothiadiazol-5-ylmethyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]azanium

Systemtic Name: 2,1,3-benzothiadiazol-5-ylmethyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]azanium Openeye Name: 2,1,3-benzothiadiazol-5-ylmethyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]ammonium CAS Name: 2,1,3-benzothiadiazol-5-ylmethyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]ammonium IUPAC Name: 2,1,3-benzothiadiazol-5-ylmethyl-[(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]azanium Traditional Name: [(4R)-1-(4-methoxyphenyl)-6,6-dimethyl-5,7-dihydro-4H-indazol-4-yl]-(piazthiol-5-ylmethyl)ammonium Formula: C23H26N5OS+ MolecularWeight: 420.55044

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2=C(C1)N(N=C2)C3=CC=C(C=C3)OC)[NH2+]CC4=CC5=NSN=C5C=C4)C

Isomeric SMILES

CC1(C[C@H](C2=C(C1)N(N=C2)C3=CC=C(C=C3)OC)[NH2+]CC4=CC5=NSN=C5C=C4)C

InChI

InChI=1S/C23H25N5OS/c1-23(2)11-21(24-13-15-4-9-19-20(10-15)27-30-26-19)18-14-25-28(22(18)12-23)16-5-7-17(29-3)8-6-16/h4-10,14,21,24H,11-13H2,1-3H3/p+1/t21-/m1/s1