3-chloranyl-N,N-bis(pyridin-3-ylmethyl)benzenecarbothioamide

Systemtic Name: 3-chloranyl-N,N-bis(pyridin-3-ylmethyl)benzenecarbothioamide Openeye Name: 3-chloro-N,N-bis(3-pyridylmethyl)benzenecarbothioamide CAS Name: 3-chloro-N,N-bis(3-pyridinylmethyl)benzenecarbothioamide IUPAC Name: 3-chloro-N,N-bis(pyridin-3-ylmethyl)benzenecarbothioamide Traditional Name: 3-chloro-N,N-bis(3-pyridylmethyl)thiobenzamide Formula: C19H16ClN3S MolecularWeight: 353.86844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)C(=S)N(CC2=CN=CC=C2)CC3=CN=CC=C3

Isomeric SMILES

C1=CC(=CC(=C1)Cl)C(=S)N(CC2=CN=CC=C2)CC3=CN=CC=C3

InChI

InChI=1S/C19H16ClN3S/c20-18-7-1-6-17(10-18)19(24)23(13-15-4-2-8-21-11-15)14-16-5-3-9-22-12-16/h1-12H,13-14H2