(3S)-1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-3-amine

Systemtic Name: (3S)-1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-3-amine Openeye Name: (3S)-1-indan-2-yl-N-methyl-N-[(2-pyrrolidin-1-ylthiazol-5-yl)methyl]piperidin-1-ium-3-amine CAS Name: (3S)-1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-N-[[2-(1-pyrrolidinyl)-5-thiazolyl]methyl]-3-piperidin-1-iumamine IUPAC Name: (3S)-1-(2,3-dihydro-1H-inden-2-yl)-N-methyl-N-[(2-pyrrolidin-1-yl-1,3-thiazol-5-yl)methyl]piperidin-1-ium-3-amine Traditional Name: [(3S)-1-indan-2-ylpiperidin-1-ium-3-yl]-methyl-[(2-pyrrolidinothiazol-5-yl)methyl]amine Formula: C23H33N4S+ MolecularWeight: 397.59992

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN=C(S1)N2CCCC2)C3CCC[NH+](C3)C4CC5=CC=CC=C5C4

Isomeric SMILES

CN(CC1=CN=C(S1)N2CCCC2)[C@H]3CCC[NH+](C3)C4CC5=CC=CC=C5C4

InChI

InChI=1S/C23H32N4S/c1-25(17-22-15-24-23(28-22)26-10-4-5-11-26)20-9-6-12-27(16-20)21-13-18-7-2-3-8-19(18)14-21/h2-3,7-8,15,20-21H,4-6,9-14,16-17H2,1H3/p+1/t20-/m0/s1