naphthalen-1-yl-[(3S)-1-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]piperidin-1-ium-3-yl]methanone

Systemtic Name: naphthalen-1-yl-[(3S)-1-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]piperidin-1-ium-3-yl]methanone Openeye Name: 1-naphthyl-[(3S)-1-[(1-thiazol-2-ylpyrrol-2-yl)methyl]piperidin-1-ium-3-yl]methanone CAS Name: 1-naphthalenyl-[(3S)-1-[[1-(2-thiazolyl)-2-pyrrolyl]methyl]-3-piperidin-1-iumyl]methanone IUPAC Name: naphthalen-1-yl-[(3S)-1-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]piperidin-1-ium-3-yl]methanone Traditional Name: 1-naphthyl-[(3S)-1-[(1-thiazol-2-ylpyrrol-2-yl)methyl]piperidin-1-ium-3-yl]methanone Formula: C24H24N3OS+ MolecularWeight: 402.53186

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C[NH+](C1)CC2=CC=CN2C3=NC=CS3)C(=O)C4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1C[C@@H](C[NH+](C1)CC2=CC=CN2C3=NC=CS3)C(=O)C4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C24H23N3OS/c28-23(22-11-3-7-18-6-1-2-10-21(18)22)19-8-4-13-26(16-19)17-20-9-5-14-27(20)24-25-12-15-29-24/h1-3,5-7,9-12,14-15,19H,4,8,13,16-17H2/p+1/t19-/m0/s1