N-tert-butyl-2-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-4-naphthalen-2-ylsulfanyl-2-oxidanyl-butyl]naphthalene-1-carboxamide

Systemtic Name: N-tert-butyl-2-[3-[(2-methyl-3-oxidanyl-phenyl)carbonylamino]-4-naphthalen-2-ylsulfanyl-2-oxidanyl-butyl]naphthalene-1-carboxamide Openeye Name: N-tert-butyl-2-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-(2-naphthylsulfanyl)butyl]naphthalene-1-carboxamide CAS Name: N-tert-butyl-2-[2-hydroxy-3-[[(3-hydroxy-2-methylphenyl)-oxomethyl]amino]-4-(2-naphthalenylthio)butyl]-1-naphthalenecarboxamide IUPAC Name: N-tert-butyl-2-[2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-naphthalen-2-ylsulfanylbutyl]naphthalene-1-carboxamide Traditional Name: N-tert-butyl-2-[2-hydroxy-3-[(3-hydroxy-2-methyl-benzoyl)amino]-4-(2-naphthylthio)butyl]-1-naphthamide Formula: C37H38N2O4S MolecularWeight: 606.77362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1O)C(=O)NC(CSC2=CC3=CC=CC=C3C=C2)C(CC4=C(C5=CC=CC=C5C=C4)C(=O)NC(C)(C)C)O

Isomeric SMILES

CC1=C(C=CC=C1O)C(=O)NC(CSC2=CC3=CC=CC=C3C=C2)C(CC4=C(C5=CC=CC=C5C=C4)C(=O)NC(C)(C)C)O

InChI

InChI=1S/C37H38N2O4S/c1-23-29(14-9-15-32(23)40)35(42)38-31(22-44-28-19-18-24-10-5-6-12-26(24)20-28)33(41)21-27-17-16-25-11-7-8-13-30(25)34(27)36(43)39-37(2,3)4/h5-20,31,33,40-41H,21-22H2,1-4H3,(H,38,42)(H,39,43)