4-(1,3-benzothiazol-2-yl)-N-(4-methyl-2-oxidanyl-phenyl)butanamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-(4-methyl-2-oxidanyl-phenyl)butanamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-(2-hydroxy-4-methyl-phenyl)butanamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)butanamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-(2-hydroxy-4-methylphenyl)butanamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-(2-hydroxy-4-methyl-phenyl)butyramide Formula: C18H18N2O2S MolecularWeight: 326.41272

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCCC2=NC3=CC=CC=C3S2)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCCC2=NC3=CC=CC=C3S2)O

InChI

InChI=1S/C18H18N2O2S/c1-12-9-10-13(15(21)11-12)19-17(22)7-4-8-18-20-14-5-2-3-6-16(14)23-18/h2-3,5-6,9-11,21H,4,7-8H2,1H3,(H,19,22)