N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide

Systemtic Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-4-(2-oxidanylidene-1,3-benzoxazol-3-yl)butanamide Openeye Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: N-[2-(methylthio)-1,3-benzothiazol-6-yl]-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide IUPAC Name: N-(2-methylsulfanyl-1,3-benzothiazol-6-yl)-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: 4-(2-keto-1,3-benzoxazol-3-yl)-N-[2-(methylthio)-1,3-benzothiazol-6-yl]butyramide Formula: C19H17N3O3S2 MolecularWeight: 399.48658

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCN3C4=CC=CC=C4OC3=O

Isomeric SMILES

CSC1=NC2=C(S1)C=C(C=C2)NC(=O)CCCN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C19H17N3O3S2/c1-26-18-21-13-9-8-12(11-16(13)27-18)20-17(23)7-4-10-22-14-5-2-3-6-15(14)25-19(22)24/h2-3,5-6,8-9,11H,4,7,10H2,1H3,(H,20,23)