7-cyclopentyl-2-[2-ethoxy-5-[ethyl-(2-hydroxyethyl)-sulfinato-azaniumyl]phenyl]-5-methyl-4-oxidanylidene-1H-imidazo[5,1-f][1,2,4]triazine

Systemtic Name: 7-cyclopentyl-2-[2-ethoxy-5-[ethyl-(2-hydroxyethyl)-sulfinato-azaniumyl]phenyl]-5-methyl-4-oxidanylidene-1H-imidazo[5,1-f][1,2,4]triazine Openeye Name: 7-cyclopentyl-2-[2-ethoxy-5-[ethyl-(2-hydroxyethyl)-sulfinato-ammonio]phenyl]-5-methyl-4-oxo-1H-imidazo[5,1-f][1,2,4]triazine CAS Name: 7-cyclopentyl-2-[2-ethoxy-5-[ethyl-(2-hydroxyethyl)-sulfinatoammonio]phenyl]-5-methyl-4-oxo-1H-imidazo[5,1-f][1,2,4]triazine IUPAC Name: 7-cyclopentyl-2-[2-ethoxy-5-[ethyl-(2-hydroxyethyl)-sulfinatoazaniumyl]phenyl]-5-methyl-4-oxo-1H-imidazo[5,1-f][1,2,4]triazine Traditional Name: 7-cyclopentyl-2-[2-ethoxy-5-[ethyl-(2-hydroxyethyl)-sulfinato-ammonio]phenyl]-4-keto-5-methyl-1H-imidazo[5,1-f][1,2,4]triazine Formula: C23H31N5O5S MolecularWeight: 489.58774

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](CCO)(C1=CC(=C(C=C1)OCC)C2=NC(=O)C3=C(N=C(N3N2)C4CCCC4)C)S(=O)[O-]

Isomeric SMILES

CC[N+](CCO)(C1=CC(=C(C=C1)OCC)C2=NC(=O)C3=C(N=C(N3N2)C4CCCC4)C)S(=O)[O-]

InChI

InChI=1S/C23H31N5O5S/c1-4-28(12-13-29,34(31)32)17-10-11-19(33-5-2)18(14-17)21-25-23(30)20-15(3)24-22(27(20)26-21)16-8-6-7-9-16/h10-11,14,16,29H,4-9,12-13H2,1-3H3,(H-,25,26,30,31,32)