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

Systemtic Name: [2-[(5-methylthiophen-2-yl)methyl-(phenylmethyl)amino]-2-oxidanylidene-ethyl]-prop-2-enyl-azanium Openeye Name: allyl-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]ammonium CAS Name: [2-[(5-methyl-2-thiophenyl)methyl-(phenylmethyl)amino]-2-oxoethyl]-prop-2-enylammonium IUPAC Name: [2-[benzyl-[(5-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]-prop-2-enylazanium Traditional Name: allyl-[2-[benzyl-[(5-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]ammonium Formula: C18H23N2OS+ MolecularWeight: 315.45302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22N2OS/c1-3-11-19-12-18(21)20(13-16-7-5-4-6-8-16)14-17-10-9-15(2)22-17/h3-10,19H,1,11-14H2,2H3/p+1