4-azanyl-5-(1,2-benzothiazol-4-yloxy)-4-oxidanyl-2-propan-2-yl-pentanethial

Systemtic Name: 4-azanyl-5-(1,2-benzothiazol-4-yloxy)-4-oxidanyl-2-propan-2-yl-pentanethial Openeye Name: 4-amino-5-(1,2-benzothiazol-4-yloxy)-4-hydroxy-2-isopropyl-pentanethial CAS Name: 4-amino-5-(1,2-benzothiazol-4-yloxy)-4-hydroxy-2-propan-2-ylpentanethial IUPAC Name: 4-amino-5-(1,2-benzothiazol-4-yloxy)-4-hydroxy-2-propan-2-ylpentanethial Traditional Name: 4-amino-5-(1,2-benzothiazol-4-yloxy)-4-hydroxy-2-isopropyl-thiovaleraldehyde Formula: C15H20N2O2S2 MolecularWeight: 324.4615

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(CC(COC1=C2C=NSC2=CC=C1)(N)O)C=S

Isomeric SMILES

CC(C)C(CC(COC1=C2C=NSC2=CC=C1)(N)O)C=S

InChI

InChI=1S/C15H20N2O2S2/c1-10(2)11(8-20)6-15(16,18)9-19-13-4-3-5-14-12(13)7-17-21-14/h3-5,7-8,10-11,18H,6,9,16H2,1-2H3