2-[(4-azanyl-6-methyl-5-oxidanylidene-1,2,4-triazin-3-yl)sulfanylmethyl]-1-butyl-N,N-diethyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[(4-azanyl-6-methyl-5-oxidanylidene-1,2,4-triazin-3-yl)sulfanylmethyl]-1-butyl-N,N-diethyl-benzimidazole-5-sulfonamide Openeye Name: 2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)sulfanylmethyl]-1-butyl-N,N-diethyl-benzimidazole-5-sulfonamide CAS Name: 2-[[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)thio]methyl]-1-butyl-N,N-diethyl-5-benzimidazolesulfonamide IUPAC Name: 2-[(4-amino-6-methyl-5-oxo-1,2,4-triazin-3-yl)sulfanylmethyl]-1-butyl-N,N-diethylbenzimidazole-5-sulfonamide Traditional Name: 2-[[(4-amino-5-keto-6-methyl-1,2,4-triazin-3-yl)thio]methyl]-1-butyl-N,N-diethyl-benzimidazole-5-sulfonamide Formula: C20H29N7O3S2 MolecularWeight: 479.61936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1CSC3=NN=C(C(=O)N3N)C

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N(CC)CC)N=C1CSC3=NN=C(C(=O)N3N)C

InChI

InChI=1S/C20H29N7O3S2/c1-5-8-11-26-17-10-9-15(32(29,30)25(6-2)7-3)12-16(17)22-18(26)13-31-20-24-23-14(4)19(28)27(20)21/h9-10,12H,5-8,11,13,21H2,1-4H3