4-(4-hydroxyphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]piperazine-1-carbothioamide

Systemtic Name: 4-(4-hydroxyphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]piperazine-1-carbothioamide Openeye Name: 4-(4-hydroxyphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]piperazine-1-carbothioamide CAS Name: 4-(4-hydroxyphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-piperazinecarbothioamide IUPAC Name: 4-(4-hydroxyphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]piperazine-1-carbothioamide Traditional Name: 4-(4-hydroxyphenyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]piperazine-1-carbothioamide Formula: C25H24N4OS2 MolecularWeight: 460.61426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)N4CCN(CC4)C5=CC=C(C=C5)O

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)N4CCN(CC4)C5=CC=C(C=C5)O

InChI

InChI=1S/C25H24N4OS2/c1-17-2-11-22-23(16-17)32-24(27-22)18-3-5-19(6-4-18)26-25(31)29-14-12-28(13-15-29)20-7-9-21(30)10-8-20/h2-11,16,30H,12-15H2,1H3,(H,26,31)