2-[2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoylamino]-N-propyl-benzamide

Systemtic Name: 2-[2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoylamino]-N-propyl-benzamide Openeye Name: 2-[[2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetyl]amino]-N-propyl-benzamide CAS Name: 2-[[2-(1,3-benzothiazol-2-ylmethylthio)-1-oxoethyl]amino]-N-propylbenzamide IUPAC Name: 2-[[2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetyl]amino]-N-propylbenzamide Traditional Name: 2-[[2-(1,3-benzothiazol-2-ylmethylthio)acetyl]amino]-N-propyl-benzamide Formula: C20H21N3O2S2 MolecularWeight: 399.52964

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=O)C1=CC=CC=C1NC(=O)CSCC2=NC3=CC=CC=C3S2

Isomeric SMILES

CCCNC(=O)C1=CC=CC=C1NC(=O)CSCC2=NC3=CC=CC=C3S2

InChI

InChI=1S/C20H21N3O2S2/c1-2-11-21-20(25)14-7-3-4-8-15(14)22-18(24)12-26-13-19-23-16-9-5-6-10-17(16)27-19/h3-10H,2,11-13H2,1H3,(H,21,25)(H,22,24)