(4-cyclohexyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methyl-[(2-methylphenyl)methyl]azanium

Systemtic Name: (4-cyclohexyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methyl-[(2-methylphenyl)methyl]azanium Openeye Name: (4-cyclohexyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-(o-tolylmethyl)ammonium CAS Name: (4-cyclohexyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methyl-[(2-methylphenyl)methyl]ammonium IUPAC Name: (4-cyclohexyl-3-methyl-5-sulfanylidene-1,2,4-triazol-1-yl)methyl-methyl-[(2-methylphenyl)methyl]azanium Traditional Name: (4-cyclohexyl-3-methyl-5-thioxo-1,2,4-triazol-1-yl)methyl-methyl-(2-methylbenzyl)ammonium Formula: C19H29N4S+ MolecularWeight: 345.52536

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C[NH+](C)CN2C(=S)N(C(=N2)C)C3CCCCC3

Isomeric SMILES

CC1=CC=CC=C1C[NH+](C)CN2C(=S)N(C(=N2)C)C3CCCCC3

InChI

InChI=1S/C19H28N4S/c1-15-9-7-8-10-17(15)13-21(3)14-22-19(24)23(16(2)20-22)18-11-5-4-6-12-18/h7-10,18H,4-6,11-14H2,1-3H3/p+1