ethyl 4-[[6-methoxy-5-[(4-methylphenyl)sulfonylamino]-6-oxidanylidene-hexyl]carbamoylamino]benzoate

Systemtic Name: ethyl 4-[[6-methoxy-5-[(4-methylphenyl)sulfonylamino]-6-oxidanylidene-hexyl]carbamoylamino]benzoate Openeye Name: ethyl 4-[[6-methoxy-6-oxo-5-(p-tolylsulfonylamino)hexyl]carbamoylamino]benzoate CAS Name: 4-[[[[6-methoxy-5-[(4-methylphenyl)sulfonylamino]-6-oxohexyl]amino]-oxomethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[6-methoxy-5-[(4-methylphenyl)sulfonylamino]-6-oxohexyl]carbamoylamino]benzoate Traditional Name: 4-[[6-keto-6-methoxy-5-(tosylamino)hexyl]carbamoylamino]benzoic acid ethyl ester Formula: C24H31N3O7S MolecularWeight: 505.58384

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)NCCCCC(C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)NCCCCC(C(=O)OC)NS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C24H31N3O7S/c1-4-34-22(28)18-10-12-19(13-11-18)26-24(30)25-16-6-5-7-21(23(29)33-3)27-35(31,32)20-14-8-17(2)9-15-20/h8-15,21,27H,4-7,16H2,1-3H3,(H2,25,26,30)