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

Systemtic Name: 4-[[6-(2-ethylhexanoylamino)indol-1-yl]methyl]-3-methoxy-N-methylsulfonyl-benzamide Openeye Name: 4-[[6-(2-ethylhexanoylamino)indol-1-yl]methyl]-3-methoxy-N-methylsulfonyl-benzamide CAS Name: 4-[[6-[(2-ethyl-1-oxohexyl)amino]-1-indolyl]methyl]-3-methoxy-N-methylsulfonylbenzamide IUPAC Name: 4-[[6-(2-ethylhexanoylamino)indol-1-yl]methyl]-3-methoxy-N-methylsulfonylbenzamide Traditional Name: 4-[[6-(2-ethylhexanoylamino)indol-1-yl]methyl]-N-mesyl-3-methoxy-benzamide Formula: C26H33N3O5S MolecularWeight: 499.62232

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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)C)OC

Isomeric SMILES

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

InChI

InChI=1S/C26H33N3O5S/c1-5-7-8-18(6-2)25(30)27-22-12-11-19-13-14-29(23(19)16-22)17-21-10-9-20(15-24(21)34-3)26(31)28-35(4,32)33/h9-16,18H,5-8,17H2,1-4H3,(H,27,30)(H,28,31)