6-[5-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-2-propoxy-phenyl]-1-(phenylmethyl)-5H-imidazo[4,5-g]quinazolin-8-one

Systemtic Name: 6-[5-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-2-propoxy-phenyl]-1-(phenylmethyl)-5H-imidazo[4,5-g]quinazolin-8-one Openeye Name: 1-benzyl-6-[5-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-2-propoxy-phenyl]-5H-imidazo[4,5-g]quinazolin-8-one CAS Name: 6-[5-[[4-(2-fluorophenyl)-1-piperazinyl]sulfonyl]-2-propoxyphenyl]-1-(phenylmethyl)-5H-imidazo[4,5-g]quinazolin-8-one IUPAC Name: 1-benzyl-6-[5-[4-(2-fluorophenyl)piperazin-1-yl]sulfonyl-2-propoxyphenyl]-5H-imidazo[4,5-g]quinazolin-8-one Traditional Name: 1-benzyl-6-[5-[4-(2-fluorophenyl)piperazino]sulfonyl-2-propoxy-phenyl]-5H-imidazo[4,5-g]quinazolin-8-one Formula: C35H33FN6O4S MolecularWeight: 652.737723

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3F)C4=NC(=O)C5=CC6=C(C=C5N4)N=CN6CC7=CC=CC=C7

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=CC=CC=C3F)C4=NC(=O)C5=CC6=C(C=C5N4)N=CN6CC7=CC=CC=C7

InChI

InChI=1S/C35H33FN6O4S/c1-2-18-46-33-13-12-25(47(44,45)42-16-14-40(15-17-42)31-11-7-6-10-28(31)36)19-27(33)34-38-29-21-30-32(20-26(29)35(43)39-34)41(23-37-30)22-24-8-4-3-5-9-24/h3-13,19-21,23H,2,14-18,22H2,1H3,(H,38,39,43)