6-[5-[3-(dimethylamino)pyrrolidin-1-yl]sulfonyl-2-propoxy-phenyl]-1-(phenylmethyl)-5H-imidazo[4,5-g]quinazolin-8-one

Systemtic Name: 6-[5-[3-(dimethylamino)pyrrolidin-1-yl]sulfonyl-2-propoxy-phenyl]-1-(phenylmethyl)-5H-imidazo[4,5-g]quinazolin-8-one Openeye Name: 1-benzyl-6-[5-[3-(dimethylamino)pyrrolidin-1-yl]sulfonyl-2-propoxy-phenyl]-5H-imidazo[4,5-g]quinazolin-8-one CAS Name: 6-[5-[[3-(dimethylamino)-1-pyrrolidinyl]sulfonyl]-2-propoxyphenyl]-1-(phenylmethyl)-5H-imidazo[4,5-g]quinazolin-8-one IUPAC Name: 1-benzyl-6-[5-[3-(dimethylamino)pyrrolidin-1-yl]sulfonyl-2-propoxyphenyl]-5H-imidazo[4,5-g]quinazolin-8-one Traditional Name: 1-benzyl-6-[5-[3-(dimethylamino)pyrrolidino]sulfonyl-2-propoxy-phenyl]-5H-imidazo[4,5-g]quinazolin-8-one Formula: C31H34N6O4S MolecularWeight: 586.70446

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(C2)N(C)C)C3=NC(=O)C4=CC5=C(C=C4N3)N=CN5CC6=CC=CC=C6

Isomeric SMILES

CCCOC1=C(C=C(C=C1)S(=O)(=O)N2CCC(C2)N(C)C)C3=NC(=O)C4=CC5=C(C=C4N3)N=CN5CC6=CC=CC=C6

InChI

InChI=1S/C31H34N6O4S/c1-4-14-41-29-11-10-23(42(39,40)37-13-12-22(19-37)35(2)3)15-25(29)30-33-26-17-27-28(16-24(26)31(38)34-30)36(20-32-27)18-21-8-6-5-7-9-21/h5-11,15-17,20,22H,4,12-14,18-19H2,1-3H3,(H,33,34,38)