2-[[8-chloranyl-5-(2-methoxyphenyl)-3H-1,4-benzodiazepin-2-yl]sulfanyl]-N,N-dimethyl-ethanamine

Systemtic Name: 2-[[8-chloranyl-5-(2-methoxyphenyl)-3H-1,4-benzodiazepin-2-yl]sulfanyl]-N,N-dimethyl-ethanamine Openeye Name: 2-[[8-chloro-5-(2-methoxyphenyl)-3H-1,4-benzodiazepin-2-yl]sulfanyl]-N,N-dimethyl-ethanamine CAS Name: 2-[[8-chloro-5-(2-methoxyphenyl)-3H-1,4-benzodiazepin-2-yl]thio]-N,N-dimethylethanamine IUPAC Name: 2-[[8-chloro-5-(2-methoxyphenyl)-3H-1,4-benzodiazepin-2-yl]sulfanyl]-N,N-dimethylethanamine Traditional Name: 2-[[8-chloro-5-(2-methoxyphenyl)-3H-1,4-benzodiazepin-2-yl]thio]ethyl-dimethyl-amine Formula: C20H22ClN3OS MolecularWeight: 387.92618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCSC1=NC2=C(C=CC(=C2)Cl)C(=NC1)C3=CC=CC=C3OC

Isomeric SMILES

CN(C)CCSC1=NC2=C(C=CC(=C2)Cl)C(=NC1)C3=CC=CC=C3OC

InChI

InChI=1S/C20H22ClN3OS/c1-24(2)10-11-26-19-13-22-20(16-6-4-5-7-18(16)25-3)15-9-8-14(21)12-17(15)23-19/h4-9,12H,10-11,13H2,1-3H3