[(1S)-1-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)propyl]-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-(thiophen-2-ylmethyl)azanium

Systemtic Name: [(1S)-1-(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)propyl]-[(5,7-dimethyl-2-oxidanylidene-1H-quinolin-3-yl)methyl]-(thiophen-2-ylmethyl)azanium Openeye Name: [(1S)-1-(1-cyclopentyltetrazol-5-yl)propyl]-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-(2-thienylmethyl)ammonium CAS Name: [(1S)-1-(1-cyclopentyl-5-tetrazolyl)propyl]-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-(thiophen-2-ylmethyl)ammonium IUPAC Name: [(1S)-1-(1-cyclopentyltetrazol-5-yl)propyl]-[(5,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-(thiophen-2-ylmethyl)azanium Traditional Name: [(1S)-1-(1-cyclopentyltetrazol-5-yl)propyl]-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]-(2-thenyl)ammonium Formula: C26H33N6OS+ MolecularWeight: 477.64482

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NN=NN1C2CCCC2)[NH+](CC3=CC=CS3)CC4=CC5=C(C=C(C=C5NC4=O)C)C

Isomeric SMILES

CC[C@@H](C1=NN=NN1C2CCCC2)[NH+](CC3=CC=CS3)CC4=CC5=C(C=C(C=C5NC4=O)C)C

InChI

InChI=1S/C26H32N6OS/c1-4-24(25-28-29-30-32(25)20-8-5-6-9-20)31(16-21-10-7-11-34-21)15-19-14-22-18(3)12-17(2)13-23(22)27-26(19)33/h7,10-14,20,24H,4-6,8-9,15-16H2,1-3H3,(H,27,33)/p+1/t24-/m0/s1