N-[(E)-1-isoquinolin-1-ylethylideneamino]-4-methyl-piperidine-1-carbothioamide

Systemtic Name: N-[(E)-1-isoquinolin-1-ylethylideneamino]-4-methyl-piperidine-1-carbothioamide Openeye Name: N-[(E)-1-(1-isoquinolyl)ethylideneamino]-4-methyl-piperidine-1-carbothioamide CAS Name: N-[(E)-1-(1-isoquinolinyl)ethylideneamino]-4-methyl-1-piperidinecarbothioamide IUPAC Name: N-[(E)-1-isoquinolin-1-ylethylideneamino]-4-methylpiperidine-1-carbothioamide Traditional Name: N-[(E)-1-(1-isoquinolyl)ethylideneamino]-4-methyl-piperidine-1-carbothioamide Formula: C18H22N4S MolecularWeight: 326.45908

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C(=S)NN=C(C)C2=NC=CC3=CC=CC=C32

Isomeric SMILES

CC1CCN(CC1)C(=S)N/N=C(\C)/C2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C18H22N4S/c1-13-8-11-22(12-9-13)18(23)21-20-14(2)17-16-6-4-3-5-15(16)7-10-19-17/h3-7,10,13H,8-9,11-12H2,1-2H3,(H,21,23)/b20-14+