N-[cyclohexyl(pyridin-2-yl)methyl]-3-(1H-indol-3-yl)-2-methyl-2-[(4-methylsulfonylphenyl)sulfonylamino]propanamide

Systemtic Name: N-[cyclohexyl(pyridin-2-yl)methyl]-3-(1H-indol-3-yl)-2-methyl-2-[(4-methylsulfonylphenyl)sulfonylamino]propanamide Openeye Name: N-[cyclohexyl(2-pyridyl)methyl]-3-(1H-indol-3-yl)-2-methyl-2-[(4-methylsulfonylphenyl)sulfonylamino]propanamide CAS Name: N-[cyclohexyl(2-pyridinyl)methyl]-3-(1H-indol-3-yl)-2-methyl-2-[(4-methylsulfonylphenyl)sulfonylamino]propanamide IUPAC Name: N-[cyclohexyl(pyridin-2-yl)methyl]-3-(1H-indol-3-yl)-2-methyl-2-[(4-methylsulfonylphenyl)sulfonylamino]propanamide Traditional Name: N-[cyclohexyl(2-pyridyl)methyl]-3-(1H-indol-3-yl)-2-[(4-mesylphenyl)sulfonylamino]-2-methyl-propionamide Formula: C31H36N4O5S2 MolecularWeight: 608.77134

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CNC2=CC=CC=C21)(C(=O)NC(C3CCCCC3)C4=CC=CC=N4)NS(=O)(=O)C5=CC=C(C=C5)S(=O)(=O)C

Isomeric SMILES

CC(CC1=CNC2=CC=CC=C21)(C(=O)NC(C3CCCCC3)C4=CC=CC=N4)NS(=O)(=O)C5=CC=C(C=C5)S(=O)(=O)C

InChI

InChI=1S/C31H36N4O5S2/c1-31(20-23-21-33-27-13-7-6-12-26(23)27,35-42(39,40)25-17-15-24(16-18-25)41(2,37)38)30(36)34-29(22-10-4-3-5-11-22)28-14-8-9-19-32-28/h6-9,12-19,21-22,29,33,35H,3-5,10-11,20H2,1-2H3,(H,34,36)