N-dodecyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide

Systemtic Name: N-dodecyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Openeye Name: N-dodecyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide CAS Name: N-dodecyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide IUPAC Name: N-dodecyl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Traditional Name: N-lauryl-3,4-dihydro-1H-isoquinoline-2-carbothioamide Formula: C22H36N2S MolecularWeight: 360.59964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCNC(=S)N1CCC2=CC=CC=C2C1

Isomeric SMILES

CCCCCCCCCCCCNC(=S)N1CCC2=CC=CC=C2C1

InChI

InChI=1S/C22H36N2S/c1-2-3-4-5-6-7-8-9-10-13-17-23-22(25)24-18-16-20-14-11-12-15-21(20)19-24/h11-12,14-15H,2-10,13,16-19H2,1H3,(H,23,25)