N-(5-piperidin-1-yl-1,3-benzothiazol-2-yl)azepane-1-carbothioamide

Systemtic Name: N-(5-piperidin-1-yl-1,3-benzothiazol-2-yl)azepane-1-carbothioamide Openeye Name: N-[5-(1-piperidyl)-1,3-benzothiazol-2-yl]azepane-1-carbothioamide CAS Name: N-[5-(1-piperidinyl)-1,3-benzothiazol-2-yl]-1-azepanecarbothioamide IUPAC Name: N-(5-piperidin-1-yl-1,3-benzothiazol-2-yl)azepane-1-carbothioamide Traditional Name: N-(5-piperidino-1,3-benzothiazol-2-yl)azepane-1-carbothioamide Formula: C19H26N4S2 MolecularWeight: 374.56654

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=S)NC2=NC3=C(S2)C=CC(=C3)N4CCCCC4

Isomeric SMILES

C1CCCN(CC1)C(=S)NC2=NC3=C(S2)C=CC(=C3)N4CCCCC4

InChI

InChI=1S/C19H26N4S2/c24-19(23-12-4-1-2-5-13-23)21-18-20-16-14-15(8-9-17(16)25-18)22-10-6-3-7-11-22/h8-9,14H,1-7,10-13H2,(H,20,21,24)