methyl (E)-4-oxidanylidene-4-(propan-2-ylamino)-3-[(4-sulfamoylphenyl)amino]but-2-enoate

Systemtic Name: methyl (E)-4-oxidanylidene-4-(propan-2-ylamino)-3-[(4-sulfamoylphenyl)amino]but-2-enoate Openeye Name: methyl (E)-4-(isopropylamino)-4-oxo-3-(4-sulfamoylanilino)but-2-enoate CAS Name: (E)-4-oxo-4-(propan-2-ylamino)-3-(4-sulfamoylanilino)-2-butenoic acid methyl ester IUPAC Name: methyl (E)-4-oxo-4-(propan-2-ylamino)-3-(4-sulfamoylanilino)but-2-enoate Traditional Name: (E)-4-(isopropylamino)-4-keto-3-(4-sulfamoylanilino)but-2-enoic acid methyl ester Formula: C14H19N3O5S MolecularWeight: 341.38276

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC(=O)OC)NC1=CC=C(C=C1)S(=O)(=O)N

Isomeric SMILES

CC(C)NC(=O)/C(=C\C(=O)OC)/NC1=CC=C(C=C1)S(=O)(=O)N

InChI

InChI=1S/C14H19N3O5S/c1-9(2)16-14(19)12(8-13(18)22-3)17-10-4-6-11(7-5-10)23(15,20)21/h4-9,17H,1-3H3,(H,16,19)(H2,15,20,21)/b12-8+