4-[2-(1,3-benzothiazol-2-ylsulfanyl)propanoylamino]benzamide

Systemtic Name: 4-[2-(1,3-benzothiazol-2-ylsulfanyl)propanoylamino]benzamide Openeye Name: 4-[2-(1,3-benzothiazol-2-ylsulfanyl)propanoylamino]benzamide CAS Name: 4-[[2-(1,3-benzothiazol-2-ylthio)-1-oxopropyl]amino]benzamide IUPAC Name: 4-[2-(1,3-benzothiazol-2-ylsulfanyl)propanoylamino]benzamide Traditional Name: 4-[2-(1,3-benzothiazol-2-ylthio)propanoylamino]benzamide Formula: C17H15N3O2S2 MolecularWeight: 357.4499

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)SC2=NC3=CC=CC=C3S2

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)N)SC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C17H15N3O2S2/c1-10(23-17-20-13-4-2-3-5-14(13)24-17)16(22)19-12-8-6-11(7-9-12)15(18)21/h2-10H,1H3,(H2,18,21)(H,19,22)