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

Systemtic Name: [3-[(3-aminocarbonylthiophen-2-yl)amino]-3-oxidanylidene-propyl]-[(4-ethylphenyl)methyl]-methyl-azanium Openeye Name: [3-[(3-carbamoyl-2-thienyl)amino]-3-oxo-propyl]-[(4-ethylphenyl)methyl]-methyl-ammonium CAS Name: [3-[(3-carbamoyl-2-thiophenyl)amino]-3-oxopropyl]-[(4-ethylphenyl)methyl]-methylammonium IUPAC Name: [3-[(3-carbamoylthiophen-2-yl)amino]-3-oxopropyl]-[(4-ethylphenyl)methyl]-methylazanium Traditional Name: [3-[(3-carbamoyl-2-thienyl)amino]-3-keto-propyl]-(4-ethylbenzyl)-methyl-ammonium Formula: C18H24N3O2S+ MolecularWeight: 346.46706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O2S/c1-3-13-4-6-14(7-5-13)12-21(2)10-8-16(22)20-18-15(17(19)23)9-11-24-18/h4-7,9,11H,3,8,10,12H2,1-2H3,(H2,19,23)(H,20,22)/p+1