N-[8-azanyl-3-(2-hydroxyethyl)-5-oxidanylidene-imidazo[4,5-d][1,3]diazepin-7-yl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[8-azanyl-3-(2-hydroxyethyl)-5-oxidanylidene-imidazo[4,5-d][1,3]diazepin-7-yl]-4-methyl-benzenesulfonamide Openeye Name: N-[8-amino-3-(2-hydroxyethyl)-5-oxo-imidazo[4,5-d][1,3]diazepin-7-yl]-4-methyl-benzenesulfonamide CAS Name: N-[8-amino-3-(2-hydroxyethyl)-5-oxo-7-imidazo[4,5-d][1,3]diazepinyl]-4-methylbenzenesulfonamide IUPAC Name: N-[8-amino-3-(2-hydroxyethyl)-5-oxoimidazo[4,5-d][1,3]diazepin-7-yl]-4-methylbenzenesulfonamide Traditional Name: N-[8-amino-3-(2-hydroxyethyl)-5-keto-imidazo[4,5-d][1,3]diazepin-7-yl]-4-methyl-benzenesulfonamide Formula: C15H16N6O4S MolecularWeight: 376.39034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=O)N=C3C(=C2N)N=CN3CCO

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=NC(=O)N=C3C(=C2N)N=CN3CCO

InChI

InChI=1S/C15H16N6O4S/c1-9-2-4-10(5-3-9)26(24,25)20-13-11(16)12-14(19-15(23)18-13)21(6-7-22)8-17-12/h2-5,8,22H,6-7H2,1H3,(H3,16,18,19,20,23)