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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)C[NH2+]C(C)C

Isomeric SMILES

CC1=CC=C(S1)CN(CC2=CC=CC=C2)C(=O)C[NH2+]C(C)C

InChI

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