N-[5-tert-butyl-6-[(6-oxidanyl-4-oxidanylidene-2-phenethyl-2-propan-2-yl-3H-pyran-5-yl)sulfanyl]-1,3-benzothiazol-2-yl]ethanamide

Systemtic Name: N-[5-tert-butyl-6-[(6-oxidanyl-4-oxidanylidene-2-phenethyl-2-propan-2-yl-3H-pyran-5-yl)sulfanyl]-1,3-benzothiazol-2-yl]ethanamide Openeye Name: N-[5-tert-butyl-6-[(6-hydroxy-2-isopropyl-4-oxo-2-phenethyl-3H-pyran-5-yl)sulfanyl]-1,3-benzothiazol-2-yl]acetamide CAS Name: N-[5-tert-butyl-6-[(6-hydroxy-4-oxo-2-phenethyl-2-propan-2-yl-3H-pyran-5-yl)thio]-1,3-benzothiazol-2-yl]acetamide IUPAC Name: N-[5-tert-butyl-6-[(6-hydroxy-4-oxo-2-phenethyl-2-propan-2-yl-3H-pyran-5-yl)sulfanyl]-1,3-benzothiazol-2-yl]acetamide Traditional Name: N-[5-tert-butyl-6-[(6-hydroxy-2-isopropyl-4-keto-2-phenethyl-3H-pyran-5-yl)thio]-1,3-benzothiazol-2-yl]acetamide Formula: C29H34N2O4S2 MolecularWeight: 538.72126

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CC(=O)C(=C(O1)O)SC2=CC3=C(C=C2C(C)(C)C)N=C(S3)NC(=O)C)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)C1(CC(=O)C(=C(O1)O)SC2=CC3=C(C=C2C(C)(C)C)N=C(S3)NC(=O)C)CCC4=CC=CC=C4

InChI

InChI=1S/C29H34N2O4S2/c1-17(2)29(13-12-19-10-8-7-9-11-19)16-22(33)25(26(34)35-29)36-23-15-24-21(14-20(23)28(4,5)6)31-27(37-24)30-18(3)32/h7-11,14-15,17,34H,12-13,16H2,1-6H3,(H,30,31,32)