4-[(2-azanyl-4-oxidanylidene-7,8-dihydro-1H-pteridin-6-yl)methylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide

Systemtic Name: 4-[(2-azanyl-4-oxidanylidene-7,8-dihydro-1H-pteridin-6-yl)methylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide Openeye Name: 4-[(2-amino-4-oxo-7,8-dihydro-1H-pteridin-6-yl)methylamino]-N-(5-methylisoxazol-3-yl)benzenesulfonamide CAS Name: 4-[(2-amino-4-oxo-7,8-dihydro-1H-pteridin-6-yl)methylamino]-N-(5-methyl-3-isoxazolyl)benzenesulfonamide IUPAC Name: 4-[(2-amino-4-oxo-7,8-dihydro-1H-pteridin-6-yl)methylamino]-N-(5-methyl-1,2-oxazol-3-yl)benzenesulfonamide Traditional Name: 4-[(2-amino-4-keto-7,8-dihydro-1H-pteridin-6-yl)methylamino]-N-(5-methylisoxazol-3-yl)benzenesulfonamide Formula: C17H18N8O4S MolecularWeight: 430.44102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NCC3=NC4=C(NC3)NC(=NC4=O)N

Isomeric SMILES

CC1=CC(=NO1)NS(=O)(=O)C2=CC=C(C=C2)NCC3=NC4=C(NC3)NC(=NC4=O)N

InChI

InChI=1S/C17H18N8O4S/c1-9-6-13(24-29-9)25-30(27,28)12-4-2-10(3-5-12)19-7-11-8-20-15-14(21-11)16(26)23-17(18)22-15/h2-6,19H,7-8H2,1H3,(H,24,25)(H4,18,20,22,23,26)