4-(1,3-benzothiazol-2-yl)-N-(phenylmethyl)piperidine-1-carbothioamide

Systemtic Name: 4-(1,3-benzothiazol-2-yl)-N-(phenylmethyl)piperidine-1-carbothioamide Openeye Name: 4-(1,3-benzothiazol-2-yl)-N-benzyl-piperidine-1-carbothioamide CAS Name: 4-(1,3-benzothiazol-2-yl)-N-(phenylmethyl)-1-piperidinecarbothioamide IUPAC Name: 4-(1,3-benzothiazol-2-yl)-N-benzylpiperidine-1-carbothioamide Traditional Name: 4-(1,3-benzothiazol-2-yl)-N-benzyl-piperidine-1-carbothioamide Formula: C20H21N3S2 MolecularWeight: 367.53084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=S)NCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1C2=NC3=CC=CC=C3S2)C(=S)NCC4=CC=CC=C4

InChI

InChI=1S/C20H21N3S2/c24-20(21-14-15-6-2-1-3-7-15)23-12-10-16(11-13-23)19-22-17-8-4-5-9-18(17)25-19/h1-9,16H,10-14H2,(H,21,24)