N-[1-[(E)-(carbamothioylhydrazinylidene)methyl]isoquinolin-4-yl]-N-methyl-ethanamide

Systemtic Name: N-[1-[(E)-(carbamothioylhydrazinylidene)methyl]isoquinolin-4-yl]-N-methyl-ethanamide Openeye Name: N-[1-[(E)-(carbamothioylhydrazono)methyl]-4-isoquinolyl]-N-methyl-acetamide CAS Name: N-[1-[(E)-(carbamothioylhydrazinylidene)methyl]-4-isoquinolinyl]-N-methylacetamide IUPAC Name: N-[1-[(E)-(carbamothioylhydrazinylidene)methyl]isoquinolin-4-yl]-N-methylacetamide Traditional Name: N-methyl-N-[1-[(E)-(thiocarbamoylhydrazono)methyl]-4-isoquinolyl]acetamide Formula: C14H15N5OS MolecularWeight: 301.3668

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C)C1=CN=C(C2=CC=CC=C21)C=NNC(=S)N

Isomeric SMILES

CC(=O)N(C)C1=CN=C(C2=CC=CC=C21)/C=N/NC(=S)N

InChI

InChI=1S/C14H15N5OS/c1-9(20)19(2)13-8-16-12(7-17-18-14(15)21)10-5-3-4-6-11(10)13/h3-8H,1-2H3,(H3,15,18,21)/b17-7+