2-(butylsulfonylamino)-3-[4-(diazanylmethylideneamino)-2-methoxy-3-phenyl-phenyl]propanoic acid

Systemtic Name: 2-(butylsulfonylamino)-3-[4-(diazanylmethylideneamino)-2-methoxy-3-phenyl-phenyl]propanoic acid Openeye Name: 2-(butylsulfonylamino)-3-[4-(hydrazinomethyleneamino)-2-methoxy-3-phenyl-phenyl]propanoic acid CAS Name: 2-(butylsulfonylamino)-3-[4-(hydrazinylmethylideneamino)-2-methoxy-3-phenylphenyl]propanoic acid IUPAC Name: 2-(butylsulfonylamino)-3-[4-(hydrazinylmethylideneamino)-2-methoxy-3-phenylphenyl]propanoic acid Traditional Name: 2-(butylsulfonylamino)-3-[4-(hydrazinomethyleneamino)-2-methoxy-3-phenyl-phenyl]propionic acid Formula: C21H28N4O5S MolecularWeight: 448.53582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(CC1=C(C(=C(C=C1)N=CNN)C2=CC=CC=C2)OC)C(=O)O

Isomeric SMILES

CCCCS(=O)(=O)NC(CC1=C(C(=C(C=C1)N=CNN)C2=CC=CC=C2)OC)C(=O)O

InChI

InChI=1S/C21H28N4O5S/c1-3-4-12-31(28,29)25-18(21(26)27)13-16-10-11-17(23-14-24-22)19(20(16)30-2)15-8-6-5-7-9-15/h5-11,14,18,25H,3-4,12-13,22H2,1-2H3,(H,23,24)(H,26,27)