4-[[6-(2-cyclopentylethanoylamino)indol-1-yl]methyl]-3-methoxy-N-pyridin-2-ylsulfonyl-benzamide

Systemtic Name: 4-[[6-(2-cyclopentylethanoylamino)indol-1-yl]methyl]-3-methoxy-N-pyridin-2-ylsulfonyl-benzamide Openeye Name: 4-[[6-[(2-cyclopentylacetyl)amino]indol-1-yl]methyl]-3-methoxy-N-(2-pyridylsulfonyl)benzamide CAS Name: 4-[[6-[(2-cyclopentyl-1-oxoethyl)amino]-1-indolyl]methyl]-3-methoxy-N-(2-pyridinylsulfonyl)benzamide IUPAC Name: 4-[[6-[(2-cyclopentylacetyl)amino]indol-1-yl]methyl]-3-methoxy-N-pyridin-2-ylsulfonylbenzamide Traditional Name: 4-[[6-[(2-cyclopentylacetyl)amino]indol-1-yl]methyl]-3-methoxy-N-(2-pyridylsulfonyl)benzamide Formula: C29H30N4O5S MolecularWeight: 546.6373

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C(=O)NS(=O)(=O)C2=CC=CC=N2)CN3C=CC4=C3C=C(C=C4)NC(=O)CC5CCCC5

Isomeric SMILES

COC1=C(C=CC(=C1)C(=O)NS(=O)(=O)C2=CC=CC=N2)CN3C=CC4=C3C=C(C=C4)NC(=O)CC5CCCC5

InChI

InChI=1S/C29H30N4O5S/c1-38-26-17-22(29(35)32-39(36,37)28-8-4-5-14-30-28)9-10-23(26)19-33-15-13-21-11-12-24(18-25(21)33)31-27(34)16-20-6-2-3-7-20/h4-5,8-15,17-18,20H,2-3,6-7,16,19H2,1H3,(H,31,34)(H,32,35)