6,7-bis(azanyl)-2-[2-(4-ethanoylpiperazin-1-yl)sulfonyl-5-propoxy-phenyl]-1H-quinazolin-4-one

Systemtic Name: 6,7-bis(azanyl)-2-[2-(4-ethanoylpiperazin-1-yl)sulfonyl-5-propoxy-phenyl]-1H-quinazolin-4-one Openeye Name: 2-[2-(4-acetylpiperazin-1-yl)sulfonyl-5-propoxy-phenyl]-6,7-diamino-1H-quinazolin-4-one CAS Name: 2-[2-[(4-acetyl-1-piperazinyl)sulfonyl]-5-propoxyphenyl]-6,7-diamino-1H-quinazolin-4-one IUPAC Name: 2-[2-(4-acetylpiperazin-1-yl)sulfonyl-5-propoxyphenyl]-6,7-diamino-1H-quinazolin-4-one Traditional Name: 2-[2-(4-acetylpiperazino)sulfonyl-5-propoxy-phenyl]-6,7-diamino-1H-quinazolin-4-one Formula: C23H28N6O5S MolecularWeight: 500.57062

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C)C3=NC(=O)C4=CC(=C(C=C4N3)N)N

Isomeric SMILES

CCCOC1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C)C3=NC(=O)C4=CC(=C(C=C4N3)N)N

InChI

InChI=1S/C23H28N6O5S/c1-3-10-34-15-4-5-21(35(32,33)29-8-6-28(7-9-29)14(2)30)17(11-15)22-26-20-13-19(25)18(24)12-16(20)23(31)27-22/h4-5,11-13H,3,6-10,24-25H2,1-2H3,(H,26,27,31)