1-[(E)-isoquinolin-3-ylmethylideneamino]thiourea

Systemtic Name: 1-[(E)-isoquinolin-3-ylmethylideneamino]thiourea Openeye Name: [(E)-3-isoquinolylmethyleneamino]thiourea CAS Name: [(E)-3-isoquinolinylmethylideneamino]thiourea IUPAC Name: [(E)-isoquinolin-3-ylmethylideneamino]thiourea Traditional Name: [(E)-3-isoquinolylmethyleneamino]thiourea Formula: C11H10N4S MolecularWeight: 230.2889

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C=NC(=CC2=C1)C=NNC(=S)N

Isomeric SMILES

C1=CC=C2C=NC(=CC2=C1)/C=N/NC(=S)N

InChI

InChI=1S/C11H10N4S/c12-11(16)15-14-7-10-5-8-3-1-2-4-9(8)6-13-10/h1-7H,(H3,12,15,16)/b14-7+