N-[5-tert-butyl-3-(oxan-4-ylmethyl)-1,3-thiazol-2-ylidene]-5-chloranyl-2-methoxy-benzamide

Systemtic Name: N-[5-tert-butyl-3-(oxan-4-ylmethyl)-1,3-thiazol-2-ylidene]-5-chloranyl-2-methoxy-benzamide Openeye Name: N-[5-tert-butyl-3-(tetrahydropyran-4-ylmethyl)thiazol-2-ylidene]-5-chloro-2-methoxy-benzamide CAS Name: N-[5-tert-butyl-3-(4-oxanylmethyl)-2-thiazolylidene]-5-chloro-2-methoxybenzamide IUPAC Name: N-[5-tert-butyl-3-(oxan-4-ylmethyl)-1,3-thiazol-2-ylidene]-5-chloro-2-methoxybenzamide Traditional Name: N-[5-tert-butyl-3-(tetrahydropyran-4-ylmethyl)-4-thiazolin-2-ylidene]-5-chloro-2-methoxy-benzamide Formula: C21H27ClN2O3S MolecularWeight: 422.96868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CN(C(=NC(=O)C2=C(C=CC(=C2)Cl)OC)S1)CC3CCOCC3

Isomeric SMILES

CC(C)(C)C1=CN(C(=NC(=O)C2=C(C=CC(=C2)Cl)OC)S1)CC3CCOCC3

InChI

InChI=1S/C21H27ClN2O3S/c1-21(2,3)18-13-24(12-14-7-9-27-10-8-14)20(28-18)23-19(25)16-11-15(22)5-6-17(16)26-4/h5-6,11,13-14H,7-10,12H2,1-4H3