(3S)-3-(1H-benzimidazol-2-yl)-N-propyl-piperidine-1-carbothioamide

Systemtic Name: (3S)-3-(1H-benzimidazol-2-yl)-N-propyl-piperidine-1-carbothioamide Openeye Name: (3S)-3-(1H-benzimidazol-2-yl)-N-propyl-piperidine-1-carbothioamide CAS Name: (3S)-3-(1H-benzimidazol-2-yl)-N-propyl-1-piperidinecarbothioamide IUPAC Name: (3S)-3-(1H-benzimidazol-2-yl)-N-propylpiperidine-1-carbothioamide Traditional Name: (3S)-3-(1H-benzimidazol-2-yl)-N-propyl-piperidine-1-carbothioamide Formula: C16H22N4S MolecularWeight: 302.43768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCNC(=S)N1CCCC(C1)C2=NC3=CC=CC=C3N2

Isomeric SMILES

CCCNC(=S)N1CCC[C@@H](C1)C2=NC3=CC=CC=C3N2

InChI

InChI=1S/C16H22N4S/c1-2-9-17-16(21)20-10-5-6-12(11-20)15-18-13-7-3-4-8-14(13)19-15/h3-4,7-8,12H,2,5-6,9-11H2,1H3,(H,17,21)(H,18,19)/t12-/m0/s1