1-(4-methylphenyl)-6-[(6-oxidanyl-1,3-benzothiazol-2-yl)amino]hexan-1-one

Systemtic Name: 1-(4-methylphenyl)-6-[(6-oxidanyl-1,3-benzothiazol-2-yl)amino]hexan-1-one Openeye Name: 6-[(6-hydroxy-1,3-benzothiazol-2-yl)amino]-1-(p-tolyl)hexan-1-one CAS Name: 6-[(6-hydroxy-1,3-benzothiazol-2-yl)amino]-1-(4-methylphenyl)-1-hexanone IUPAC Name: 6-[(6-hydroxy-1,3-benzothiazol-2-yl)amino]-1-(4-methylphenyl)hexan-1-one Traditional Name: 6-[(6-hydroxy-1,3-benzothiazol-2-yl)amino]-1-(p-tolyl)hexan-1-one Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CCCCCNC2=NC3=C(S2)C=C(C=C3)O

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CCCCCNC2=NC3=C(S2)C=C(C=C3)O

InChI

InChI=1S/C20H22N2O2S/c1-14-6-8-15(9-7-14)18(24)5-3-2-4-12-21-20-22-17-11-10-16(23)13-19(17)25-20/h6-11,13,23H,2-5,12H2,1H3,(H,21,22)