[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(4-ethylphenyl)methyl]-methyl-azanium

Systemtic Name: [2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl]-[(4-ethylphenyl)methyl]-methyl-azanium Openeye Name: [2-[(3-carbamoyl-2-thienyl)amino]-2-oxo-ethyl]-[(4-ethylphenyl)methyl]-methyl-ammonium CAS Name: [2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl]-[(4-ethylphenyl)methyl]-methylammonium IUPAC Name: [2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl]-[(4-ethylphenyl)methyl]-methylazanium Traditional Name: [2-[(3-carbamoyl-2-thienyl)amino]-2-keto-ethyl]-(4-ethylbenzyl)-methyl-ammonium Formula: C17H22N3O2S+ MolecularWeight: 332.44048

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C[NH+](C)CC(=O)NC2=C(C=CS2)C(=O)N

Isomeric SMILES

CCC1=CC=C(C=C1)C[NH+](C)CC(=O)NC2=C(C=CS2)C(=O)N

InChI

InChI=1S/C17H21N3O2S/c1-3-12-4-6-13(7-5-12)10-20(2)11-15(21)19-17-14(16(18)22)8-9-23-17/h4-9H,3,10-11H2,1-2H3,(H2,18,22)(H,19,21)/p+1