N-[[4-(5,9-diethoxy-6-oxidanylidene-8H-pyrrolo[3,4-g]quinolin-7-yl)-3-methyl-phenyl]methylsulfonyl]-1-phenyl-cyclopropane-1-carboxamide

Systemtic Name: N-[[4-(5,9-diethoxy-6-oxidanylidene-8H-pyrrolo[3,4-g]quinolin-7-yl)-3-methyl-phenyl]methylsulfonyl]-1-phenyl-cyclopropane-1-carboxamide Openeye Name: N-[[4-(5,9-diethoxy-6-oxo-8H-pyrrolo[3,4-g]quinolin-7-yl)-3-methyl-phenyl]methylsulfonyl]-1-phenyl-cyclopropanecarboxamide CAS Name: N-[[4-(5,9-diethoxy-6-oxo-8H-pyrrolo[3,4-g]quinolin-7-yl)-3-methylphenyl]methylsulfonyl]-1-phenyl-1-cyclopropanecarboxamide IUPAC Name: N-[[4-(5,9-diethoxy-6-oxo-8H-pyrrolo[3,4-g]quinolin-7-yl)-3-methylphenyl]methylsulfonyl]-1-phenylcyclopropane-1-carboxamide Traditional Name: N-[4-(5,9-diethoxy-6-keto-8H-pyrrolo[3,4-g]quinolin-7-yl)-3-methyl-benzyl]sulfonyl-1-phenyl-cyclopropanecarboxamide Formula: C33H33N3O6S MolecularWeight: 599.69662

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2CN(C(=O)C2=C(C3=C1N=CC=C3)OCC)C4=C(C=C(C=C4)CS(=O)(=O)NC(=O)C5(CC5)C6=CC=CC=C6)C

Isomeric SMILES

CCOC1=C2CN(C(=O)C2=C(C3=C1N=CC=C3)OCC)C4=C(C=C(C=C4)CS(=O)(=O)NC(=O)C5(CC5)C6=CC=CC=C6)C

InChI

InChI=1S/C33H33N3O6S/c1-4-41-29-24-12-9-17-34-28(24)30(42-5-2)25-19-36(31(37)27(25)29)26-14-13-22(18-21(26)3)20-43(39,40)35-32(38)33(15-16-33)23-10-7-6-8-11-23/h6-14,17-18H,4-5,15-16,19-20H2,1-3H3,(H,35,38)