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

Systemtic Name: 3-(hydroxymethyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]piperidine-1-carbothioamide Openeye Name: 3-(hydroxymethyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]piperidine-1-carbothioamide CAS Name: 3-(hydroxymethyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-1-piperidinecarbothioamide IUPAC Name: 3-(hydroxymethyl)-N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]piperidine-1-carbothioamide Traditional Name: N-[4-(6-methyl-1,3-benzothiazol-2-yl)phenyl]-3-methylol-piperidine-1-carbothioamide Formula: C21H23N3OS2 MolecularWeight: 397.55682

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)N4CCCC(C4)CO

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(S2)C3=CC=C(C=C3)NC(=S)N4CCCC(C4)CO

InChI

InChI=1S/C21H23N3OS2/c1-14-4-9-18-19(11-14)27-20(23-18)16-5-7-17(8-6-16)22-21(26)24-10-2-3-15(12-24)13-25/h4-9,11,15,25H,2-3,10,12-13H2,1H3,(H,22,26)