2-[(6-tert-butyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-N-(3-methylbutyl)-1,3-thiazole-4-carboxamide

Systemtic Name: 2-[(6-tert-butyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]-N-(3-methylbutyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-N-isopentyl-thiazole-4-carboxamide CAS Name: 2-[(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-N-(3-methylbutyl)-4-thiazolecarboxamide IUPAC Name: 2-[(6-tert-butyl-3-oxo-1,4-benzoxazin-4-yl)methyl]-N-(3-methylbutyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[(6-tert-butyl-3-keto-1,4-benzoxazin-4-yl)methyl]-N-isoamyl-thiazole-4-carboxamide Formula: C22H29N3O3S MolecularWeight: 415.54896

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCNC(=O)C1=CSC(=N1)CN2C(=O)COC3=C2C=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C)CCNC(=O)C1=CSC(=N1)CN2C(=O)COC3=C2C=C(C=C3)C(C)(C)C

InChI

InChI=1S/C22H29N3O3S/c1-14(2)8-9-23-21(27)16-13-29-19(24-16)11-25-17-10-15(22(3,4)5)6-7-18(17)28-12-20(25)26/h6-7,10,13-14H,8-9,11-12H2,1-5H3,(H,23,27)