N-tert-butyl-1-[3-[2-(tert-butylcarbamoyl)phenyl]sulfanyl-2-oxidanyl-propyl]-4-phenyl-pyrrole-3-carboxamide

Systemtic Name: N-tert-butyl-1-[3-[2-(tert-butylcarbamoyl)phenyl]sulfanyl-2-oxidanyl-propyl]-4-phenyl-pyrrole-3-carboxamide Openeye Name: N-tert-butyl-1-[3-[2-(tert-butylcarbamoyl)phenyl]sulfanyl-2-hydroxy-propyl]-4-phenyl-pyrrole-3-carboxamide CAS Name: N-tert-butyl-1-[3-[[2-[(tert-butylamino)-oxomethyl]phenyl]thio]-2-hydroxypropyl]-4-phenyl-3-pyrrolecarboxamide IUPAC Name: N-tert-butyl-1-[3-[2-(tert-butylcarbamoyl)phenyl]sulfanyl-2-hydroxypropyl]-4-phenylpyrrole-3-carboxamide Traditional Name: N-tert-butyl-1-[3-[[2-(tert-butylcarbamoyl)phenyl]thio]-2-hydroxy-propyl]-4-phenyl-pyrrole-3-carboxamide Formula: C29H37N3O3S MolecularWeight: 507.68738

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC=CC=C1SCC(CN2C=C(C(=C2)C(=O)NC(C)(C)C)C3=CC=CC=C3)O

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC=CC=C1SCC(CN2C=C(C(=C2)C(=O)NC(C)(C)C)C3=CC=CC=C3)O

InChI

InChI=1S/C29H37N3O3S/c1-28(2,3)30-26(34)22-14-10-11-15-25(22)36-19-21(33)16-32-17-23(20-12-8-7-9-13-20)24(18-32)27(35)31-29(4,5)6/h7-15,17-18,21,33H,16,19H2,1-6H3,(H,30,34)(H,31,35)