1-ethyl-3-isoquinolin-5-yl-thiourea

Systemtic Name: 1-ethyl-3-isoquinolin-5-yl-thiourea Openeye Name: 1-ethyl-3-(5-isoquinolyl)thiourea CAS Name: 1-ethyl-3-(5-isoquinolinyl)thiourea IUPAC Name: 1-ethyl-3-isoquinolin-5-ylthiourea Traditional Name: 1-ethyl-3-(5-isoquinolyl)thiourea Formula: C12H13N3S MolecularWeight: 231.31672

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=S)NC1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CCNC(=S)NC1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C12H13N3S/c1-2-14-12(16)15-11-5-3-4-9-8-13-7-6-10(9)11/h3-8H,2H2,1H3,(H2,14,15,16)