[1-[(E)-(carbamothioylhydrazinylidene)methyl]-4-methyl-isoquinolin-5-yl] ethanoate

Systemtic Name: [1-[(E)-(carbamothioylhydrazinylidene)methyl]-4-methyl-isoquinolin-5-yl] ethanoate Openeye Name: [1-[(E)-(carbamothioylhydrazono)methyl]-4-methyl-5-isoquinolyl] acetate CAS Name: acetic acid [1-[(E)-(carbamothioylhydrazinylidene)methyl]-4-methyl-5-isoquinolinyl] ester IUPAC Name: [1-[(E)-(carbamothioylhydrazinylidene)methyl]-4-methylisoquinolin-5-yl] acetate Traditional Name: acetic acid [4-methyl-1-[(E)-(thiocarbamoylhydrazono)methyl]-5-isoquinolyl] ester Formula: C14H14N4O2S MolecularWeight: 302.35156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C2=C1C(=CC=C2)OC(=O)C)C=NNC(=S)N

Isomeric SMILES

CC1=CN=C(C2=C1C(=CC=C2)OC(=O)C)/C=N/NC(=S)N

InChI

InChI=1S/C14H14N4O2S/c1-8-6-16-11(7-17-18-14(15)21)10-4-3-5-12(13(8)10)20-9(2)19/h3-7H,1-2H3,(H3,15,18,21)/b17-7+