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

Systemtic Name: 3-methoxy-4-[[6-(2-phenylbutanoylamino)indol-1-yl]methyl]-N-(phenylsulfonyl)benzamide Openeye Name: N-(benzenesulfonyl)-3-methoxy-4-[[6-(2-phenylbutanoylamino)indol-1-yl]methyl]benzamide CAS Name: N-(benzenesulfonyl)-3-methoxy-4-[[6-[(1-oxo-2-phenylbutyl)amino]-1-indolyl]methyl]benzamide IUPAC Name: N-(benzenesulfonyl)-3-methoxy-4-[[6-(2-phenylbutanoylamino)indol-1-yl]methyl]benzamide Traditional Name: N-besyl-3-methoxy-4-[[6-(2-phenylbutanoylamino)indol-1-yl]methyl]benzamide Formula: C33H31N3O5S MolecularWeight: 581.68134

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)C=CN3CC4=C(C=C(C=C4)C(=O)NS(=O)(=O)C5=CC=CC=C5)OC

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)NC2=CC3=C(C=C2)C=CN3CC4=C(C=C(C=C4)C(=O)NS(=O)(=O)C5=CC=CC=C5)OC

InChI

InChI=1S/C33H31N3O5S/c1-3-29(23-10-6-4-7-11-23)33(38)34-27-17-16-24-18-19-36(30(24)21-27)22-26-15-14-25(20-31(26)41-2)32(37)35-42(39,40)28-12-8-5-9-13-28/h4-21,29H,3,22H2,1-2H3,(H,34,38)(H,35,37)