[2-(3-methylbutylamino)-2-oxidanylidene-ethyl]-[(R)-(4-methylphenyl)-thiophen-2-yl-methyl]azanium

Systemtic Name: [2-(3-methylbutylamino)-2-oxidanylidene-ethyl]-[(R)-(4-methylphenyl)-thiophen-2-yl-methyl]azanium Openeye Name: [2-(isopentylamino)-2-oxo-ethyl]-[(R)-p-tolyl(2-thienyl)methyl]ammonium CAS Name: [2-(3-methylbutylamino)-2-oxoethyl]-[(R)-(4-methylphenyl)-thiophen-2-ylmethyl]ammonium IUPAC Name: [2-(3-methylbutylamino)-2-oxoethyl]-[(R)-(4-methylphenyl)-thiophen-2-ylmethyl]azanium Traditional Name: [2-(isoamylamino)-2-keto-ethyl]-[(R)-p-tolyl(2-thienyl)methyl]ammonium Formula: C19H27N2OS+ MolecularWeight: 331.49548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CS2)[NH2+]CC(=O)NCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)[C@H](C2=CC=CS2)[NH2+]CC(=O)NCCC(C)C

InChI

InChI=1S/C19H26N2OS/c1-14(2)10-11-20-18(22)13-21-19(17-5-4-12-23-17)16-8-6-15(3)7-9-16/h4-9,12,14,19,21H,10-11,13H2,1-3H3,(H,20,22)/p+1/t19-/m1/s1