6-azanyl-N-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: 6-azanyl-N-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: 6-amino-N-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: 6-amino-N-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: 6-amino-N-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: 6-amino-N-[2-(4-chlorophenyl)ethyl]-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C18H20ClN3S MolecularWeight: 345.8895

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=C(C=C2)N)C(=S)NCCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CN(CC2=C1C=C(C=C2)N)C(=S)NCCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C18H20ClN3S/c19-16-4-1-13(2-5-16)7-9-21-18(23)22-10-8-14-11-17(20)6-3-15(14)12-22/h1-6,11H,7-10,12,20H2,(H,21,23)