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

Systemtic Name: 1-(phenylmethyl)-6-[5-(4-phenylpiperazin-1-yl)sulfonyl-2-propoxy-phenyl]-5H-imidazo[4,5-g]quinazolin-8-one Openeye Name: 1-benzyl-6-[5-(4-phenylpiperazin-1-yl)sulfonyl-2-propoxy-phenyl]-5H-imidazo[4,5-g]quinazolin-8-one CAS Name: 1-(phenylmethyl)-6-[5-[(4-phenyl-1-piperazinyl)sulfonyl]-2-propoxyphenyl]-5H-imidazo[4,5-g]quinazolin-8-one IUPAC Name: 1-benzyl-6-[5-(4-phenylpiperazin-1-yl)sulfonyl-2-propoxyphenyl]-5H-imidazo[4,5-g]quinazolin-8-one Traditional Name: 1-benzyl-6-[5-(4-phenylpiperazino)sulfonyl-2-propoxy-phenyl]-5H-imidazo[4,5-g]quinazolin-8-one Formula: C35H34N6O4S MolecularWeight: 634.74726

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C35H34N6O4S/c1-2-19-45-33-14-13-27(46(43,44)41-17-15-39(16-18-41)26-11-7-4-8-12-26)20-29(33)34-37-30-22-31-32(21-28(30)35(42)38-34)40(24-36-31)23-25-9-5-3-6-10-25/h3-14,20-22,24H,2,15-19,23H2,1H3,(H,37,38,42)