2-[3-(1,3-benzoxazol-2-ylsulfanyl)propanoylamino]benzamide

Systemtic Name: 2-[3-(1,3-benzoxazol-2-ylsulfanyl)propanoylamino]benzamide Openeye Name: 2-[3-(1,3-benzoxazol-2-ylsulfanyl)propanoylamino]benzamide CAS Name: 2-[[3-(1,3-benzoxazol-2-ylthio)-1-oxopropyl]amino]benzamide IUPAC Name: 2-[3-(1,3-benzoxazol-2-ylsulfanyl)propanoylamino]benzamide Traditional Name: 2-[3-(1,3-benzoxazol-2-ylthio)propanoylamino]benzamide Formula: C17H15N3O3S MolecularWeight: 341.3843

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)N)NC(=O)CCSC2=NC3=CC=CC=C3O2

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)N)NC(=O)CCSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C17H15N3O3S/c18-16(22)11-5-1-2-6-12(11)19-15(21)9-10-24-17-20-13-7-3-4-8-14(13)23-17/h1-8H,9-10H2,(H2,18,22)(H,19,21)