N-(4-dimethylaminophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: N-(4-dimethylaminophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-(4-dimethylaminophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-(4-dimethylaminophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-(4-dimethylaminophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-(4-dimethylaminophenyl)-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C18H21N3S MolecularWeight: 311.44444

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)NC(=S)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CN(C)C1=CC=C(C=C1)NC(=S)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C18H21N3S/c1-20(2)17-9-7-16(8-10-17)19-18(22)21-12-11-14-5-3-4-6-15(14)13-21/h3-10H,11-13H2,1-2H3,(H,19,22)