(phenylmethyl) 2-[(4-benzamidophenyl)sulfonylamino]-3-(1H-imidazol-5-yl)propanoate

Systemtic Name: (phenylmethyl) 2-[(4-benzamidophenyl)sulfonylamino]-3-(1H-imidazol-5-yl)propanoate Openeye Name: benzyl 2-[(4-benzamidophenyl)sulfonylamino]-3-(1H-imidazol-5-yl)propanoate CAS Name: 2-[(4-benzamidophenyl)sulfonylamino]-3-(1H-imidazol-5-yl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(4-benzamidophenyl)sulfonylamino]-3-(1H-imidazol-5-yl)propanoate Traditional Name: 2-[(4-benzamidophenyl)sulfonylamino]-3-(1H-imidazol-5-yl)propionic acid benzyl ester Formula: C26H24N4O5S MolecularWeight: 504.55756

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CC2=CN=CN2)NS(=O)(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CC2=CN=CN2)NS(=O)(=O)C3=CC=C(C=C3)NC(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H24N4O5S/c31-25(20-9-5-2-6-10-20)29-21-11-13-23(14-12-21)36(33,34)30-24(15-22-16-27-18-28-22)26(32)35-17-19-7-3-1-4-8-19/h1-14,16,18,24,30H,15,17H2,(H,27,28)(H,29,31)