2-(1,3-benzoxazol-2-ylsulfanyl)-N,N'-diphenyl-butanediamide

Systemtic Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N,N'-diphenyl-butanediamide Openeye Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N,N'-diphenyl-butanediamide CAS Name: 2-(1,3-benzoxazol-2-ylthio)-N,N'-diphenylbutanediamide IUPAC Name: 2-(1,3-benzoxazol-2-ylsulfanyl)-N,N'-diphenylbutanediamide Traditional Name: 2-(1,3-benzoxazol-2-ylthio)-N,N'-diphenyl-succinamide Formula: C23H19N3O3S MolecularWeight: 417.48026

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CC(C(=O)NC2=CC=CC=C2)SC3=NC4=CC=CC=C4O3

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CC(C(=O)NC2=CC=CC=C2)SC3=NC4=CC=CC=C4O3

InChI

InChI=1S/C23H19N3O3S/c27-21(24-16-9-3-1-4-10-16)15-20(22(28)25-17-11-5-2-6-12-17)30-23-26-18-13-7-8-14-19(18)29-23/h1-14,20H,15H2,(H,24,27)(H,25,28)