[2-oxidanylidene-2-(propylcarbamoylamino)ethyl]-[(R)-(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]azanium

Systemtic Name: [2-oxidanylidene-2-(propylcarbamoylamino)ethyl]-[(R)-(4-propan-2-ylphenyl)-thiophen-2-yl-methyl]azanium Openeye Name: [(R)-(4-isopropylphenyl)-(2-thienyl)methyl]-[2-oxo-2-(propylcarbamoylamino)ethyl]ammonium CAS Name: [2-oxo-2-[[oxo(propylamino)methyl]amino]ethyl]-[(R)-(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]ammonium IUPAC Name: [2-oxo-2-(propylcarbamoylamino)ethyl]-[(R)-(4-propan-2-ylphenyl)-thiophen-2-ylmethyl]azanium Traditional Name: [2-keto-2-(propylcarbamoylamino)ethyl]-[(R)-p-cumenyl(2-thienyl)methyl]ammonium Formula: C20H28N3O2S+ MolecularWeight: 374.52022

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)NC(=O)C[NH2+]C(C1=CC=C(C=C1)C(C)C)C2=CC=CS2

Isomeric SMILES

CCCNC(=O)NC(=O)C[NH2+][C@H](C1=CC=C(C=C1)C(C)C)C2=CC=CS2

InChI

InChI=1S/C20H27N3O2S/c1-4-11-21-20(25)23-18(24)13-22-19(17-6-5-12-26-17)16-9-7-15(8-10-16)14(2)3/h5-10,12,14,19,22H,4,11,13H2,1-3H3,(H2,21,23,24,25)/p+1/t19-/m1/s1