4-(2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[3-(phenylmethylsulfanyl)-1,2,4-thiadiazol-5-yl]butanamide

Systemtic Name: 4-(2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[3-(phenylmethylsulfanyl)-1,2,4-thiadiazol-5-yl]butanamide Openeye Name: N-(3-benzylsulfanyl-1,2,4-thiadiazol-5-yl)-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide CAS Name: 4-(2-oxo-1,3-benzoxazol-3-yl)-N-[3-(phenylmethylthio)-1,2,4-thiadiazol-5-yl]butanamide IUPAC Name: N-(3-benzylsulfanyl-1,2,4-thiadiazol-5-yl)-4-(2-oxo-1,3-benzoxazol-3-yl)butanamide Traditional Name: N-[3-(benzylthio)-1,2,4-thiadiazol-5-yl]-4-(2-keto-1,3-benzoxazol-3-yl)butyramide Formula: C20H18N4O3S2 MolecularWeight: 426.51192

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=NSC(=N2)NC(=O)CCCN3C4=CC=CC=C4OC3=O

Isomeric SMILES

C1=CC=C(C=C1)CSC2=NSC(=N2)NC(=O)CCCN3C4=CC=CC=C4OC3=O

InChI

InChI=1S/C20H18N4O3S2/c25-17(11-6-12-24-15-9-4-5-10-16(15)27-20(24)26)21-18-22-19(23-29-18)28-13-14-7-2-1-3-8-14/h1-5,7-10H,6,11-13H2,(H,21,22,23,25)