(5-phenyl-1H-pyrrol-3-yl) 5-(1-azanylethylideneamino)-2-[(4-methylphenyl)sulfonylamino]pentanoate

Systemtic Name: (5-phenyl-1H-pyrrol-3-yl) 5-(1-azanylethylideneamino)-2-[(4-methylphenyl)sulfonylamino]pentanoate Openeye Name: (5-phenyl-1H-pyrrol-3-yl) 5-(1-aminoethylideneamino)-2-(p-tolylsulfonylamino)pentanoate CAS Name: 5-(1-aminoethylideneamino)-2-[(4-methylphenyl)sulfonylamino]pentanoic acid (5-phenyl-1H-pyrrol-3-yl) ester IUPAC Name: (5-phenyl-1H-pyrrol-3-yl) 5-(1-aminoethylideneamino)-2-[(4-methylphenyl)sulfonylamino]pentanoate Traditional Name: 5-(1-aminoethylideneamino)-2-(tosylamino)valeric acid (5-phenyl-1H-pyrrol-3-yl) ester Formula: C24H28N4O4S MolecularWeight: 468.56852

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCN=C(C)N)C(=O)OC2=CNC(=C2)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CCCN=C(C)N)C(=O)OC2=CNC(=C2)C3=CC=CC=C3

InChI

InChI=1S/C24H28N4O4S/c1-17-10-12-21(13-11-17)33(30,31)28-22(9-6-14-26-18(2)25)24(29)32-20-15-23(27-16-20)19-7-4-3-5-8-19/h3-5,7-8,10-13,15-16,22,27-28H,6,9,14H2,1-2H3,(H2,25,26)