[(1-cyanocyclohexyl)amino] 3,4-dihydro-1H-isoquinoline-2-carbodithioate

Systemtic Name: [(1-cyanocyclohexyl)amino] 3,4-dihydro-1H-isoquinoline-2-carbodithioate Openeye Name: [(1-cyanocyclohexyl)amino] 3,4-dihydro-1H-isoquinoline-2-carbodithioate CAS Name: 3,4-dihydro-1H-isoquinoline-2-carbodithioic acid [(1-cyanocyclohexyl)amino] ester IUPAC Name: [(1-cyanocyclohexyl)amino] 3,4-dihydro-1H-isoquinoline-2-carbodithioate Traditional Name: 3,4-dihydro-1H-isoquinoline-2-carbodithioic acid [(1-cyanocyclohexyl)amino] ester Formula: C17H21N3S2 MolecularWeight: 331.49874

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)(C#N)NSC(=S)N2CCC3=CC=CC=C3C2

Isomeric SMILES

C1CCC(CC1)(C#N)NSC(=S)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C17H21N3S2/c18-13-17(9-4-1-5-10-17)19-22-16(21)20-11-8-14-6-2-3-7-15(14)12-20/h2-3,6-7,19H,1,4-5,8-12H2