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

Systemtic Name: 1-adamantyl-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]azanium Openeye Name: 1-adamantyl-[(1-thiazol-2-ylpyrrol-2-yl)methyl]ammonium CAS Name: 1-adamantyl-[[1-(2-thiazolyl)-2-pyrrolyl]methyl]ammonium IUPAC Name: 1-adamantyl-[[1-(1,3-thiazol-2-yl)pyrrol-2-yl]methyl]azanium Traditional Name: 1-adamantyl-[(1-thiazol-2-ylpyrrol-2-yl)methyl]ammonium Formula: C18H24N3S+ MolecularWeight: 314.46826

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=CC=CN4C5=NC=CS5

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)[NH2+]CC4=CC=CN4C5=NC=CS5

InChI

InChI=1S/C18H23N3S/c1-2-16(21(4-1)17-19-3-5-22-17)12-20-18-9-13-6-14(10-18)8-15(7-13)11-18/h1-5,13-15,20H,6-12H2/p+1