4,6-bis[[bis(2-methylpropyl)amino]methylsulfanyl]-N-phenyl-1,3,5-triazin-2-amine

Systemtic Name: 4,6-bis[[bis(2-methylpropyl)amino]methylsulfanyl]-N-phenyl-1,3,5-triazin-2-amine Openeye Name: 4,6-bis[(diisobutylamino)methylsulfanyl]-N-phenyl-1,3,5-triazin-2-amine CAS Name: 4,6-bis[[bis(2-methylpropyl)amino]methylthio]-N-phenyl-1,3,5-triazin-2-amine IUPAC Name: 4,6-bis[[bis(2-methylpropyl)amino]methylsulfanyl]-N-phenyl-1,3,5-triazin-2-amine Traditional Name: [[4-anilino-6-[(diisobutylamino)methylthio]-s-triazin-2-yl]thio]methyl-diisobutyl-amine Formula: C27H46N6S2 MolecularWeight: 518.82434

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)CSC1=NC(=NC(=N1)NC2=CC=CC=C2)SCN(CC(C)C)CC(C)C

Isomeric SMILES

CC(C)CN(CC(C)C)CSC1=NC(=NC(=N1)NC2=CC=CC=C2)SCN(CC(C)C)CC(C)C

InChI

InChI=1S/C27H46N6S2/c1-20(2)14-32(15-21(3)4)18-34-26-29-25(28-24-12-10-9-11-13-24)30-27(31-26)35-19-33(16-22(5)6)17-23(7)8/h9-13,20-23H,14-19H2,1-8H3,(H,28,29,30,31)