tert-butyl-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]azanium

Systemtic Name: tert-butyl-[2-oxidanylidene-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]azanium Openeye Name: [2-[benzyl(2-thienylmethyl)amino]-2-oxo-ethyl]-tert-butyl-ammonium CAS Name: tert-butyl-[2-oxo-2-[(phenylmethyl)-(thiophen-2-ylmethyl)amino]ethyl]ammonium IUPAC Name: [2-[benzyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-tert-butylazanium Traditional Name: [2-[benzyl(2-thenyl)amino]-2-keto-ethyl]-tert-butyl-ammonium Formula: C18H25N2OS+ MolecularWeight: 317.4689

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)[NH2+]CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2

Isomeric SMILES

CC(C)(C)[NH2+]CC(=O)N(CC1=CC=CC=C1)CC2=CC=CS2

InChI

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