[4-azanyl-6-[(4-fluorophenyl)amino]-1,3,5-triazin-2-yl]methyl N-cyclohexyl-N-methyl-carbamodithioate

Systemtic Name: [4-azanyl-6-[(4-fluorophenyl)amino]-1,3,5-triazin-2-yl]methyl N-cyclohexyl-N-methyl-carbamodithioate Openeye Name: [4-amino-6-(4-fluoroanilino)-1,3,5-triazin-2-yl]methyl N-cyclohexyl-N-methyl-carbamodithioate CAS Name: N-cyclohexyl-N-methylcarbamodithioic acid [4-amino-6-(4-fluoroanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(4-fluoroanilino)-1,3,5-triazin-2-yl]methyl N-cyclohexyl-N-methylcarbamodithioate Traditional Name: N-cyclohexyl-N-methyl-carbamodithioic acid [4-amino-6-(4-fluoroanilino)-s-triazin-2-yl]methyl ester Formula: C18H23FN6S2 MolecularWeight: 406.543823

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCCCC1)C(=S)SCC2=NC(=NC(=N2)NC3=CC=C(C=C3)F)N

Isomeric SMILES

CN(C1CCCCC1)C(=S)SCC2=NC(=NC(=N2)NC3=CC=C(C=C3)F)N

InChI

InChI=1S/C18H23FN6S2/c1-25(14-5-3-2-4-6-14)18(26)27-11-15-22-16(20)24-17(23-15)21-13-9-7-12(19)8-10-13/h7-10,14H,2-6,11H2,1H3,(H3,20,21,22,23,24)