5-[(2-azanyl-5-propan-2-yl-1,3-benzothiazol-6-yl)sulfanyl]-6-oxidanyl-2-phenethyl-2-propan-2-yl-3H-pyran-4-one

Systemtic Name: 5-[(2-azanyl-5-propan-2-yl-1,3-benzothiazol-6-yl)sulfanyl]-6-oxidanyl-2-phenethyl-2-propan-2-yl-3H-pyran-4-one Openeye Name: 5-[(2-amino-5-isopropyl-1,3-benzothiazol-6-yl)sulfanyl]-6-hydroxy-2-isopropyl-2-phenethyl-3H-pyran-4-one CAS Name: 5-[(2-amino-5-propan-2-yl-1,3-benzothiazol-6-yl)thio]-6-hydroxy-2-phenethyl-2-propan-2-yl-3H-pyran-4-one IUPAC Name: 5-[(2-amino-5-propan-2-yl-1,3-benzothiazol-6-yl)sulfanyl]-6-hydroxy-2-phenethyl-2-propan-2-yl-3H-pyran-4-one Traditional Name: 5-[(2-amino-5-isopropyl-1,3-benzothiazol-6-yl)thio]-6-hydroxy-2-isopropyl-2-phenethyl-3H-pyran-4-one Formula: C26H30N2O3S2 MolecularWeight: 482.658

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1SC3=C(OC(CC3=O)(CCC4=CC=CC=C4)C(C)C)O)SC(=N2)N

Isomeric SMILES

CC(C)C1=CC2=C(C=C1SC3=C(OC(CC3=O)(CCC4=CC=CC=C4)C(C)C)O)SC(=N2)N

InChI

InChI=1S/C26H30N2O3S2/c1-15(2)18-12-19-22(33-25(27)28-19)13-21(18)32-23-20(29)14-26(16(3)4,31-24(23)30)11-10-17-8-6-5-7-9-17/h5-9,12-13,15-16,30H,10-11,14H2,1-4H3,(H2,27,28)