(phenylmethyl) 2-[(5-chloranylthiophen-2-yl)sulfonylamino]-3-(1H-indol-3-yl)propanoate

Systemtic Name: (phenylmethyl) 2-[(5-chloranylthiophen-2-yl)sulfonylamino]-3-(1H-indol-3-yl)propanoate Openeye Name: benzyl 2-[(5-chloro-2-thienyl)sulfonylamino]-3-(1H-indol-3-yl)propanoate CAS Name: 2-[(5-chloro-2-thiophenyl)sulfonylamino]-3-(1H-indol-3-yl)propanoic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(5-chlorothiophen-2-yl)sulfonylamino]-3-(1H-indol-3-yl)propanoate Traditional Name: 2-[(5-chloro-2-thienyl)sulfonylamino]-3-(1H-indol-3-yl)propionic acid benzyl ester Formula: C22H19ClN2O4S2 MolecularWeight: 474.98026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)C(CC2=CNC3=CC=CC=C32)NS(=O)(=O)C4=CC=C(S4)Cl

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)C(CC2=CNC3=CC=CC=C32)NS(=O)(=O)C4=CC=C(S4)Cl

InChI

InChI=1S/C22H19ClN2O4S2/c23-20-10-11-21(30-20)31(27,28)25-19(22(26)29-14-15-6-2-1-3-7-15)12-16-13-24-18-9-5-4-8-17(16)18/h1-11,13,19,24-25H,12,14H2