[2-[[3-(cyclopropylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [2-[[3-(cyclopropylcarbamoyl)phenyl]amino]-2-oxidanylidene-ethyl]-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [2-[3-(cyclopropylcarbamoyl)anilino]-2-oxo-ethyl]-methyl-(3-thienylmethyl)ammonium CAS Name: [2-[3-[(cyclopropylamino)-oxomethyl]anilino]-2-oxoethyl]-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [2-[3-(cyclopropylcarbamoyl)anilino]-2-oxoethyl]-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [2-[3-(cyclopropylcarbamoyl)anilino]-2-keto-ethyl]-methyl-(3-thenyl)ammonium Formula: C18H22N3O2S+ MolecularWeight: 344.45118

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CSC=C1)CC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3

Isomeric SMILES

C[NH+](CC1=CSC=C1)CC(=O)NC2=CC=CC(=C2)C(=O)NC3CC3

InChI

InChI=1S/C18H21N3O2S/c1-21(10-13-7-8-24-12-13)11-17(22)19-16-4-2-3-14(9-16)18(23)20-15-5-6-15/h2-4,7-9,12,15H,5-6,10-11H2,1H3,(H,19,22)(H,20,23)/p+1