4-(2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]butanamide

Systemtic Name: 4-(2-oxidanylidene-1,3-benzoxazol-3-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]butanamide Openeye Name: 4-(2-oxo-1,3-benzoxazol-3-yl)-N-[2-(3-thienylmethylsulfanyl)phenyl]butanamide CAS Name: 4-(2-oxo-1,3-benzoxazol-3-yl)-N-[2-(3-thiophenylmethylthio)phenyl]butanamide IUPAC Name: 4-(2-oxo-1,3-benzoxazol-3-yl)-N-[2-(thiophen-3-ylmethylsulfanyl)phenyl]butanamide Traditional Name: 4-(2-keto-1,3-benzoxazol-3-yl)-N-[2-(3-thenylthio)phenyl]butyramide Formula: C22H20N2O3S2 MolecularWeight: 424.5358

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC(=O)CCCN2C3=CC=CC=C3OC2=O)SCC4=CSC=C4

Isomeric SMILES

C1=CC=C(C(=C1)NC(=O)CCCN2C3=CC=CC=C3OC2=O)SCC4=CSC=C4

InChI

InChI=1S/C22H20N2O3S2/c25-21(10-5-12-24-18-7-2-3-8-19(18)27-22(24)26)23-17-6-1-4-9-20(17)29-15-16-11-13-28-14-16/h1-4,6-9,11,13-14H,5,10,12,15H2,(H,23,25)