N-[(E)-1-isoquinolin-1-ylethylideneamino]-2,6-dimethyl-morpholine-4-carbothioamide

Systemtic Name: N-[(E)-1-isoquinolin-1-ylethylideneamino]-2,6-dimethyl-morpholine-4-carbothioamide Openeye Name: N-[(E)-1-(1-isoquinolyl)ethylideneamino]-2,6-dimethyl-morpholine-4-carbothioamide CAS Name: N-[(E)-1-(1-isoquinolinyl)ethylideneamino]-2,6-dimethyl-4-morpholinecarbothioamide IUPAC Name: N-[(E)-1-isoquinolin-1-ylethylideneamino]-2,6-dimethylmorpholine-4-carbothioamide Traditional Name: N-[(E)-1-(1-isoquinolyl)ethylideneamino]-2,6-dimethyl-morpholine-4-carbothioamide Formula: C18H22N4OS MolecularWeight: 342.45848

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CC(O1)C)C(=S)NN=C(C)C2=NC=CC3=CC=CC=C32

Isomeric SMILES

CC1CN(CC(O1)C)C(=S)N/N=C(\C)/C2=NC=CC3=CC=CC=C32

InChI

InChI=1S/C18H22N4OS/c1-12-10-22(11-13(2)23-12)18(24)21-20-14(3)17-16-7-5-4-6-15(16)8-9-19-17/h4-9,12-13H,10-11H2,1-3H3,(H,21,24)/b20-14+