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

Systemtic Name: 2-[2-(1,3-benzothiazol-2-ylmethylsulfanyl)ethanoylamino]-N-cyclopropyl-benzamide Openeye Name: 2-[[2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetyl]amino]-N-cyclopropyl-benzamide CAS Name: 2-[[2-(1,3-benzothiazol-2-ylmethylthio)-1-oxoethyl]amino]-N-cyclopropylbenzamide IUPAC Name: 2-[[2-(1,3-benzothiazol-2-ylmethylsulfanyl)acetyl]amino]-N-cyclopropylbenzamide Traditional Name: 2-[[2-(1,3-benzothiazol-2-ylmethylthio)acetyl]amino]-N-cyclopropyl-benzamide Formula: C20H19N3O2S2 MolecularWeight: 397.51376

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC(=O)C2=CC=CC=C2NC(=O)CSCC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CC1NC(=O)C2=CC=CC=C2NC(=O)CSCC3=NC4=CC=CC=C4S3

InChI

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