2-(2-butoxy-5-methylsulfonyl-phenyl)-7-ethyl-5-prop-2-enyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one

Systemtic Name: 2-(2-butoxy-5-methylsulfonyl-phenyl)-7-ethyl-5-prop-2-enyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one Openeye Name: 5-allyl-2-(2-butoxy-5-methylsulfonyl-phenyl)-7-ethyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one CAS Name: 2-(2-butoxy-5-methylsulfonylphenyl)-7-ethyl-5-prop-2-enyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one IUPAC Name: 2-(2-butoxy-5-methylsulfonylphenyl)-7-ethyl-5-prop-2-enyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one Traditional Name: 5-allyl-2-(2-butoxy-5-mesyl-phenyl)-7-ethyl-1H-imidazo[5,1-f][1,2,4]triazin-4-one Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)S(=O)(=O)C)C2=NC(=O)C3=C(N=C(N3N2)CC)CC=C

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)S(=O)(=O)C)C2=NC(=O)C3=C(N=C(N3N2)CC)CC=C

InChI

InChI=1S/C21H26N4O4S/c1-5-8-12-29-17-11-10-14(30(4,27)28)13-15(17)20-23-21(26)19-16(9-6-2)22-18(7-3)25(19)24-20/h6,10-11,13H,2,5,7-9,12H2,1,3-4H3,(H,23,24,26)