[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methyl-[(1R)-1-thiophen-2-ylethyl]azanium

Systemtic Name: [2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methyl-[(1R)-1-thiophen-2-ylethyl]azanium Openeye Name: [2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrol-3-yl]methyl-[(1R)-1-(2-thienyl)ethyl]ammonium CAS Name: [2,5-dimethyl-1-(5-methyl-3-isoxazolyl)-3-pyrrolyl]methyl-[(1R)-1-thiophen-2-ylethyl]ammonium IUPAC Name: [2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]methyl-[(1R)-1-thiophen-2-ylethyl]azanium Traditional Name: [2,5-dimethyl-1-(5-methylisoxazol-3-yl)pyrrol-3-yl]methyl-[(1R)-1-(2-thienyl)ethyl]ammonium Formula: C17H22N3OS+ MolecularWeight: 316.44108

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=NOC(=C2)C)C)C[NH2+]C(C)C3=CC=CS3

Isomeric SMILES

CC1=CC(=C(N1C2=NOC(=C2)C)C)C[NH2+][C@H](C)C3=CC=CS3

InChI

InChI=1S/C17H21N3OS/c1-11-8-15(10-18-13(3)16-6-5-7-22-16)14(4)20(11)17-9-12(2)21-19-17/h5-9,13,18H,10H2,1-4H3/p+1/t13-/m1/s1