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

Systemtic Name: 3-[3-(1,3-benzothiazol-2-ylsulfanyl)propanoylamino]-N-cyclopropyl-benzamide Openeye Name: 3-[3-(1,3-benzothiazol-2-ylsulfanyl)propanoylamino]-N-cyclopropyl-benzamide CAS Name: 3-[[3-(1,3-benzothiazol-2-ylthio)-1-oxopropyl]amino]-N-cyclopropylbenzamide IUPAC Name: 3-[3-(1,3-benzothiazol-2-ylsulfanyl)propanoylamino]-N-cyclopropylbenzamide Traditional Name: 3-[3-(1,3-benzothiazol-2-ylthio)propanoylamino]-N-cyclopropyl-benzamide Formula: C20H19N3O2S2 MolecularWeight: 397.51376

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)CCSC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC1NC(=O)C2=CC(=CC=C2)NC(=O)CCSC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C20H19N3O2S2/c24-18(10-11-26-20-23-16-6-1-2-7-17(16)27-20)21-15-5-3-4-13(12-15)19(25)22-14-8-9-14/h1-7,12,14H,8-11H2,(H,21,24)(H,22,25)