[3-[(3-aminocarbonylthiophen-2-yl)amino]-3-oxidanylidene-propyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium

Systemtic Name: [3-[(3-aminocarbonylthiophen-2-yl)amino]-3-oxidanylidene-propyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium Openeye Name: [3-[(3-carbamoyl-2-thienyl)amino]-3-oxo-propyl]-methyl-[(4-methylsulfanylphenyl)methyl]ammonium CAS Name: [3-[(3-carbamoyl-2-thiophenyl)amino]-3-oxopropyl]-methyl-[[4-(methylthio)phenyl]methyl]ammonium IUPAC Name: [3-[(3-carbamoylthiophen-2-yl)amino]-3-oxopropyl]-methyl-[(4-methylsulfanylphenyl)methyl]azanium Traditional Name: [3-[(3-carbamoyl-2-thienyl)amino]-3-keto-propyl]-methyl-[4-(methylthio)benzyl]ammonium Formula: C17H22N3O2S2+ MolecularWeight: 364.50548

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCC(=O)NC1=C(C=CS1)C(=O)N)CC2=CC=C(C=C2)SC

Isomeric SMILES

C[NH+](CCC(=O)NC1=C(C=CS1)C(=O)N)CC2=CC=C(C=C2)SC

InChI

InChI=1S/C17H21N3O2S2/c1-20(11-12-3-5-13(23-2)6-4-12)9-7-15(21)19-17-14(16(18)22)8-10-24-17/h3-6,8,10H,7,9,11H2,1-2H3,(H2,18,22)(H,19,21)/p+1