N4-heptan-4-yl-6-methyl-N2-(4-methylsulfonylphenyl)pyridine-2,3,4-triamine

Systemtic Name: N4-heptan-4-yl-6-methyl-N2-(4-methylsulfonylphenyl)pyridine-2,3,4-triamine Openeye Name: 6-methyl-N2-(4-methylsulfonylphenyl)-N4-(1-propylbutyl)pyridine-2,3,4-triamine CAS Name: N4-heptan-4-yl-6-methyl-N2-(4-methylsulfonylphenyl)pyridine-2,3,4-triamine IUPAC Name: 4-N-heptan-4-yl-6-methyl-2-N-(4-methylsulfonylphenyl)pyridine-2,3,4-triamine Traditional Name: [3-amino-2-(4-mesylanilino)-6-methyl-4-pyridyl]-(1-propylbutyl)amine Formula: C20H30N4O2S MolecularWeight: 390.5428

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC)NC1=CC(=NC(=C1N)NC2=CC=C(C=C2)S(=O)(=O)C)C

Isomeric SMILES

CCCC(CCC)NC1=CC(=NC(=C1N)NC2=CC=C(C=C2)S(=O)(=O)C)C

InChI

InChI=1S/C20H30N4O2S/c1-5-7-15(8-6-2)23-18-13-14(3)22-20(19(18)21)24-16-9-11-17(12-10-16)27(4,25)26/h9-13,15H,5-8,21H2,1-4H3,(H2,22,23,24)