4-[[[4,6-bis(butylamino)-1,3,5-triazin-2-yl]amino]methyl]benzenesulfonamide

Systemtic Name: 4-[[[4,6-bis(butylamino)-1,3,5-triazin-2-yl]amino]methyl]benzenesulfonamide Openeye Name: 4-[[[4,6-bis(butylamino)-1,3,5-triazin-2-yl]amino]methyl]benzenesulfonamide CAS Name: 4-[[[4,6-bis(butylamino)-1,3,5-triazin-2-yl]amino]methyl]benzenesulfonamide IUPAC Name: 4-[[[4,6-bis(butylamino)-1,3,5-triazin-2-yl]amino]methyl]benzenesulfonamide Traditional Name: 4-[[[4,6-bis(butylamino)-s-triazin-2-yl]amino]methyl]benzenesulfonamide Formula: C18H29N7O2S MolecularWeight: 407.53356

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=NC(=NC(=N1)NCC2=CC=C(C=C2)S(=O)(=O)N)NCCCC

Isomeric SMILES

CCCCNC1=NC(=NC(=N1)NCC2=CC=C(C=C2)S(=O)(=O)N)NCCCC

InChI

InChI=1S/C18H29N7O2S/c1-3-5-11-20-16-23-17(21-12-6-4-2)25-18(24-16)22-13-14-7-9-15(10-8-14)28(19,26)27/h7-10H,3-6,11-13H2,1-2H3,(H2,19,26,27)(H3,20,21,22,23,24,25)