[(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]-[2-(2-methylpropylamino)-2-oxidanylidene-ethyl]azanium

Systemtic Name: [(R)-(4-ethylphenyl)-thiophen-2-yl-methyl]-[2-(2-methylpropylamino)-2-oxidanylidene-ethyl]azanium Openeye Name: [(R)-(4-ethylphenyl)-(2-thienyl)methyl]-[2-(isobutylamino)-2-oxo-ethyl]ammonium CAS Name: [(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]-[2-(2-methylpropylamino)-2-oxoethyl]ammonium IUPAC Name: [(R)-(4-ethylphenyl)-thiophen-2-ylmethyl]-[2-(2-methylpropylamino)-2-oxoethyl]azanium Traditional Name: [(R)-(4-ethylphenyl)-(2-thienyl)methyl]-[2-(isobutylamino)-2-keto-ethyl]ammonium Formula: C19H27N2OS+ MolecularWeight: 331.49548

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C(C2=CC=CS2)[NH2+]CC(=O)NCC(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)[C@H](C2=CC=CS2)[NH2+]CC(=O)NCC(C)C

InChI

InChI=1S/C19H26N2OS/c1-4-15-7-9-16(10-8-15)19(17-6-5-11-23-17)21-13-18(22)20-12-14(2)3/h5-11,14,19,21H,4,12-13H2,1-3H3,(H,20,22)/p+1/t19-/m1/s1