diethyl-[(1S)-2-[(4-methoxyphenyl)carbamoylamino]-1-thiophen-3-yl-ethyl]azanium

Systemtic Name: diethyl-[(1S)-2-[(4-methoxyphenyl)carbamoylamino]-1-thiophen-3-yl-ethyl]azanium Openeye Name: diethyl-[(1S)-2-[(4-methoxyphenyl)carbamoylamino]-1-(3-thienyl)ethyl]ammonium CAS Name: diethyl-[(1S)-2-[[(4-methoxyanilino)-oxomethyl]amino]-1-(3-thiophenyl)ethyl]ammonium IUPAC Name: diethyl-[(1S)-2-[(4-methoxyphenyl)carbamoylamino]-1-thiophen-3-ylethyl]azanium Traditional Name: diethyl-[(1S)-2-[(4-methoxyphenyl)carbamoylamino]-1-(3-thienyl)ethyl]ammonium Formula: C18H26N3O2S+ MolecularWeight: 348.48294

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)C(CNC(=O)NC1=CC=C(C=C1)OC)C2=CSC=C2

Isomeric SMILES

CC[NH+](CC)[C@H](CNC(=O)NC1=CC=C(C=C1)OC)C2=CSC=C2

InChI

InChI=1S/C18H25N3O2S/c1-4-21(5-2)17(14-10-11-24-13-14)12-19-18(22)20-15-6-8-16(23-3)9-7-15/h6-11,13,17H,4-5,12H2,1-3H3,(H2,19,20,22)/p+1/t17-/m1/s1