4-[[6-(2-ethylhexanoylamino)indol-1-yl]methyl]-N-(4-fluorophenyl)sulfonyl-3-methoxy-benzamide

Systemtic Name: 4-[[6-(2-ethylhexanoylamino)indol-1-yl]methyl]-N-(4-fluorophenyl)sulfonyl-3-methoxy-benzamide Openeye Name: 4-[[6-(2-ethylhexanoylamino)indol-1-yl]methyl]-N-(4-fluorophenyl)sulfonyl-3-methoxy-benzamide CAS Name: 4-[[6-[(2-ethyl-1-oxohexyl)amino]-1-indolyl]methyl]-N-(4-fluorophenyl)sulfonyl-3-methoxybenzamide IUPAC Name: 4-[[6-(2-ethylhexanoylamino)indol-1-yl]methyl]-N-(4-fluorophenyl)sulfonyl-3-methoxybenzamide Traditional Name: 4-[[6-(2-ethylhexanoylamino)indol-1-yl]methyl]-N-(4-fluorophenyl)sulfonyl-3-methoxy-benzamide Formula: C31H34FN3O5S MolecularWeight: 579.682163

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)C(=O)NC1=CC2=C(C=C1)C=CN2CC3=C(C=C(C=C3)C(=O)NS(=O)(=O)C4=CC=C(C=C4)F)OC

Isomeric SMILES

CCCCC(CC)C(=O)NC1=CC2=C(C=C1)C=CN2CC3=C(C=C(C=C3)C(=O)NS(=O)(=O)C4=CC=C(C=C4)F)OC

InChI

InChI=1S/C31H34FN3O5S/c1-4-6-7-21(5-2)30(36)33-26-13-10-22-16-17-35(28(22)19-26)20-24-9-8-23(18-29(24)40-3)31(37)34-41(38,39)27-14-11-25(32)12-15-27/h8-19,21H,4-7,20H2,1-3H3,(H,33,36)(H,34,37)