cyclohexyl-[2-[(4-fluorophenyl)methyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]azanium

Systemtic Name: cyclohexyl-[2-[(4-fluorophenyl)methyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxidanylidene-ethyl]azanium Openeye Name: cyclohexyl-[2-[(4-fluorophenyl)methyl-[(3-methyl-2-thienyl)methyl]amino]-2-oxo-ethyl]ammonium CAS Name: cyclohexyl-[2-[(4-fluorophenyl)methyl-[(3-methyl-2-thiophenyl)methyl]amino]-2-oxoethyl]ammonium IUPAC Name: cyclohexyl-[2-[(4-fluorophenyl)methyl-[(3-methylthiophen-2-yl)methyl]amino]-2-oxoethyl]azanium Traditional Name: cyclohexyl-[2-[(4-fluorobenzyl)-[(3-methyl-2-thienyl)methyl]amino]-2-keto-ethyl]ammonium Formula: C21H28FN2OS+ MolecularWeight: 375.523223

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)CN(CC2=CC=C(C=C2)F)C(=O)C[NH2+]C3CCCCC3

Isomeric SMILES

CC1=C(SC=C1)CN(CC2=CC=C(C=C2)F)C(=O)C[NH2+]C3CCCCC3

InChI

InChI=1S/C21H27FN2OS/c1-16-11-12-26-20(16)15-24(14-17-7-9-18(22)10-8-17)21(25)13-23-19-5-3-2-4-6-19/h7-12,19,23H,2-6,13-15H2,1H3/p+1