N-[1-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonylpiperidin-4-yl]benzamide

Systemtic Name: N-[1-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)phenyl]carbonylpiperidin-4-yl]benzamide Openeye Name: N-[1-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]-4-piperidyl]benzamide CAS Name: N-[1-[[4-[(1,3-benzothiazol-2-ylthio)methyl]phenyl]-oxomethyl]-4-piperidinyl]benzamide IUPAC Name: N-[1-[4-(1,3-benzothiazol-2-ylsulfanylmethyl)benzoyl]piperidin-4-yl]benzamide Traditional Name: N-[1-[4-[(1,3-benzothiazol-2-ylthio)methyl]benzoyl]-4-piperidyl]benzamide Formula: C27H25N3O2S2 MolecularWeight: 487.6363

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC=CC=C2)C(=O)C3=CC=C(C=C3)CSC4=NC5=CC=CC=C5S4

InChI

InChI=1S/C27H25N3O2S2/c31-25(20-6-2-1-3-7-20)28-22-14-16-30(17-15-22)26(32)21-12-10-19(11-13-21)18-33-27-29-23-8-4-5-9-24(23)34-27/h1-13,22H,14-18H2,(H,28,31)