3-[6,7-bis(azanyl)-4-oxidanylidene-1H-quinazolin-2-yl]-4-propoxy-N-(pyridin-4-ylmethyl)benzenesulfonamide

Systemtic Name: 3-[6,7-bis(azanyl)-4-oxidanylidene-1H-quinazolin-2-yl]-4-propoxy-N-(pyridin-4-ylmethyl)benzenesulfonamide Openeye Name: 3-(6,7-diamino-4-oxo-1H-quinazolin-2-yl)-4-propoxy-N-(4-pyridylmethyl)benzenesulfonamide CAS Name: 3-(6,7-diamino-4-oxo-1H-quinazolin-2-yl)-4-propoxy-N-(pyridin-4-ylmethyl)benzenesulfonamide IUPAC Name: 3-(6,7-diamino-4-oxo-1H-quinazolin-2-yl)-4-propoxy-N-(pyridin-4-ylmethyl)benzenesulfonamide Traditional Name: 3-(6,7-diamino-4-keto-1H-quinazolin-2-yl)-4-propoxy-N-(4-pyridylmethyl)benzenesulfonamide Formula: C23H24N6O4S MolecularWeight: 480.53946

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=NC=C2)C3=NC(=O)C4=CC(=C(C=C4N3)N)N

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)NCC2=CC=NC=C2)C3=NC(=O)C4=CC(=C(C=C4N3)N)N

InChI

InChI=1S/C23H24N6O4S/c1-2-9-33-21-4-3-15(34(31,32)27-13-14-5-7-26-8-6-14)10-17(21)22-28-20-12-19(25)18(24)11-16(20)23(30)29-22/h3-8,10-12,27H,2,9,13,24-25H2,1H3,(H,28,29,30)