2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]benzamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-[[3-(cyclopropylcarbonylamino)phenyl]methyl]benzamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]benzamide CAS Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-[[3-[[cyclopropyl(oxo)methyl]amino]phenyl]methyl]benzamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanylmethyl)-N-[[3-(cyclopropanecarbonylamino)phenyl]methyl]benzamide Traditional Name: 2-[(1,3-benzoxazol-2-ylthio)methyl]-N-[3-(cyclopropanecarbonylamino)benzyl]benzamide Formula: C26H23N3O3S MolecularWeight: 457.54412

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)C3=CC=CC=C3CSC4=NC5=CC=CC=C5O4

Isomeric SMILES

C1CC1C(=O)NC2=CC=CC(=C2)CNC(=O)C3=CC=CC=C3CSC4=NC5=CC=CC=C5O4

InChI

InChI=1S/C26H23N3O3S/c30-24(18-12-13-18)28-20-8-5-6-17(14-20)15-27-25(31)21-9-2-1-7-19(21)16-33-26-29-22-10-3-4-11-23(22)32-26/h1-11,14,18H,12-13,15-16H2,(H,27,31)(H,28,30)