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

Systemtic Name: [4-azanyl-6-[(4-methylphenyl)amino]-1,3,5-triazin-2-yl]methyl N-cyclohexyl-N-methyl-carbamodithioate Openeye Name: [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl N-cyclohexyl-N-methyl-carbamodithioate CAS Name: N-cyclohexyl-N-methylcarbamodithioic acid [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl ester IUPAC Name: [4-amino-6-(4-methylanilino)-1,3,5-triazin-2-yl]methyl N-cyclohexyl-N-methylcarbamodithioate Traditional Name: N-cyclohexyl-N-methyl-carbamodithioic acid [4-amino-6-(p-toluidino)-s-triazin-2-yl]methyl ester Formula: C19H26N6S2 MolecularWeight: 402.57994

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC(=S)N(C)C3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC2=NC(=NC(=N2)N)CSC(=S)N(C)C3CCCCC3

InChI

InChI=1S/C19H26N6S2/c1-13-8-10-14(11-9-13)21-18-23-16(22-17(20)24-18)12-27-19(26)25(2)15-6-4-3-5-7-15/h8-11,15H,3-7,12H2,1-2H3,(H3,20,21,22,23,24)