methyl-(phenylmethyl)-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]azanium

Systemtic Name: methyl-(phenylmethyl)-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]azanium Openeye Name: benzyl-methyl-[(1-thiazol-2-ylpyrrol-2-yl)methyl]ammonium CAS Name: methyl-(phenylmethyl)-[[1-(2-thiazolyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: benzyl-methyl-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]azanium Traditional Name: benzyl-methyl-[(1-thiazol-2-ylpyrrol-2-yl)methyl]ammonium Formula: C16H18N3S+ MolecularWeight: 284.39922

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CC=CC=C1)CC2=CC=CN2C3=NC=CS3

Isomeric SMILES

C[NH+](CC1=CC=CC=C1)CC2=CC=CN2C3=NC=CS3

InChI

InChI=1S/C16H17N3S/c1-18(12-14-6-3-2-4-7-14)13-15-8-5-10-19(15)16-17-9-11-20-16/h2-11H,12-13H2,1H3/p+1