[2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-propyl-azanium

Systemtic Name: [2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-propyl-azanium Openeye Name: [2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]-propyl-ammonium CAS Name: [2-[(5-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-propylammonium IUPAC Name: [2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-propylazanium Traditional Name: [2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]-propyl-ammonium Formula: C18H25N2OS+ MolecularWeight: 317.4689

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH2+]CC(=O)N(CC1=CC=CC=C1)CC2=CC=C(S2)C

Isomeric SMILES

CCC[NH2+]CC(=O)N(CC1=CC=CC=C1)CC2=CC=C(S2)C

InChI

InChI=1S/C18H24N2OS/c1-3-11-19-12-18(21)20(13-16-7-5-4-6-8-16)14-17-10-9-15(2)22-17/h4-10,19H,3,11-14H2,1-2H3/p+1