methyl 3-(1H-indol-3-yl)-2-[[3-methyl-2-(naphthalen-1-ylsulfonylamino)pentanoyl]amino]propanoate

Systemtic Name: methyl 3-(1H-indol-3-yl)-2-[[3-methyl-2-(naphthalen-1-ylsulfonylamino)pentanoyl]amino]propanoate Openeye Name: methyl 3-(1H-indol-3-yl)-2-[[3-methyl-2-(1-naphthylsulfonylamino)pentanoyl]amino]propanoate CAS Name: 3-(1H-indol-3-yl)-2-[[3-methyl-2-(1-naphthalenylsulfonylamino)-1-oxopentyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-(1H-indol-3-yl)-2-[[3-methyl-2-(naphthalen-1-ylsulfonylamino)pentanoyl]amino]propanoate Traditional Name: 3-(1H-indol-3-yl)-2-[[3-methyl-2-(1-naphthylsulfonylamino)pentanoyl]amino]propionic acid methyl ester Formula: C28H31N3O5S MolecularWeight: 521.62784

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC)NS(=O)(=O)C3=CC=CC4=CC=CC=C43

Isomeric SMILES

CCC(C)C(C(=O)NC(CC1=CNC2=CC=CC=C21)C(=O)OC)NS(=O)(=O)C3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C28H31N3O5S/c1-4-18(2)26(31-37(34,35)25-15-9-11-19-10-5-6-13-22(19)25)27(32)30-24(28(33)36-3)16-20-17-29-23-14-8-7-12-21(20)23/h5-15,17-18,24,26,29,31H,4,16H2,1-3H3,(H,30,32)