[2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(3-methylthiophen-2-yl)methyl]azanium

Systemtic Name: [2-[(3-iodanylphenyl)amino]-2-oxidanylidene-ethyl]-methyl-[(3-methylthiophen-2-yl)methyl]azanium Openeye Name: [2-(3-iodoanilino)-2-oxo-ethyl]-methyl-[(3-methyl-2-thienyl)methyl]ammonium CAS Name: [2-(3-iodoanilino)-2-oxoethyl]-methyl-[(3-methyl-2-thiophenyl)methyl]ammonium IUPAC Name: [2-(3-iodoanilino)-2-oxoethyl]-methyl-[(3-methylthiophen-2-yl)methyl]azanium Traditional Name: [2-(3-iodoanilino)-2-keto-ethyl]-methyl-[(3-methyl-2-thienyl)methyl]ammonium Formula: C15H18IN2OS+ MolecularWeight: 401.28569

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C[NH+](C)CC(=O)NC2=CC(=CC=C2)I

Isomeric SMILES

CC1=C(SC=C1)C[NH+](C)CC(=O)NC2=CC(=CC=C2)I

InChI

InChI=1S/C15H17IN2OS/c1-11-6-7-20-14(11)9-18(2)10-15(19)17-13-5-3-4-12(16)8-13/h3-8H,9-10H2,1-2H3,(H,17,19)/p+1