1-isoquinolin-5-yl-3-propan-2-yl-thiourea

Systemtic Name: 1-isoquinolin-5-yl-3-propan-2-yl-thiourea Openeye Name: 1-isopropyl-3-(5-isoquinolyl)thiourea CAS Name: 1-(5-isoquinolinyl)-3-propan-2-ylthiourea IUPAC Name: 1-isoquinolin-5-yl-3-propan-2-ylthiourea Traditional Name: 1-isopropyl-3-(5-isoquinolyl)thiourea Formula: C13H15N3S MolecularWeight: 245.3433

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=S)NC1=CC=CC2=C1C=CN=C2

Isomeric SMILES

CC(C)NC(=S)NC1=CC=CC2=C1C=CN=C2

InChI

InChI=1S/C13H15N3S/c1-9(2)15-13(17)16-12-5-3-4-10-8-14-7-6-11(10)12/h3-9H,1-2H3,(H2,15,16,17)