4-(1,3-benzoxazol-2-ylsulfanyl)-N-(2,4,6-trimethylphenyl)butanamide

Systemtic Name: 4-(1,3-benzoxazol-2-ylsulfanyl)-N-(2,4,6-trimethylphenyl)butanamide Openeye Name: 4-(1,3-benzoxazol-2-ylsulfanyl)-N-(2,4,6-trimethylphenyl)butanamide CAS Name: 4-(1,3-benzoxazol-2-ylthio)-N-(2,4,6-trimethylphenyl)butanamide IUPAC Name: 4-(1,3-benzoxazol-2-ylsulfanyl)-N-(2,4,6-trimethylphenyl)butanamide Traditional Name: 4-(1,3-benzoxazol-2-ylthio)-N-mesityl-butyramide Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)CCCSC2=NC3=CC=CC=C3O2)C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)CCCSC2=NC3=CC=CC=C3O2)C

InChI

InChI=1S/C20H22N2O2S/c1-13-11-14(2)19(15(3)12-13)22-18(23)9-6-10-25-20-21-16-7-4-5-8-17(16)24-20/h4-5,7-8,11-12H,6,9-10H2,1-3H3,(H,22,23)