4-[[2,4-bis(oxidanylidene)-7-(phenylsulfonylamino)-1-propyl-quinazolin-3-yl]methyl]benzenecarboximidamide

Systemtic Name: 4-[[2,4-bis(oxidanylidene)-7-(phenylsulfonylamino)-1-propyl-quinazolin-3-yl]methyl]benzenecarboximidamide Openeye Name: 4-[[7-(benzenesulfonamido)-2,4-dioxo-1-propyl-quinazolin-3-yl]methyl]benzamidine CAS Name: 4-[[7-(benzenesulfonamido)-2,4-dioxo-1-propyl-3-quinazolinyl]methyl]benzenecarboximidamide IUPAC Name: 4-[[7-(benzenesulfonamido)-2,4-dioxo-1-propylquinazolin-3-yl]methyl]benzenecarboximidamide Traditional Name: 4-[[7-(benzenesulfonamido)-2,4-diketo-1-propyl-quinazolin-3-yl]methyl]benzamidine Formula: C25H25N5O4S MolecularWeight: 491.5621

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)C(=O)N(C1=O)CC4=CC=C(C=C4)C(=N)N

Isomeric SMILES

CCCN1C2=C(C=CC(=C2)NS(=O)(=O)C3=CC=CC=C3)C(=O)N(C1=O)CC4=CC=C(C=C4)C(=N)N

InChI

InChI=1S/C25H25N5O4S/c1-2-14-29-22-15-19(28-35(33,34)20-6-4-3-5-7-20)12-13-21(22)24(31)30(25(29)32)16-17-8-10-18(11-9-17)23(26)27/h3-13,15,28H,2,14,16H2,1H3,(H3,26,27)