1-(3-chlorophenyl)-3-isoquinolin-5-yl-thiourea

Systemtic Name: 1-(3-chlorophenyl)-3-isoquinolin-5-yl-thiourea Openeye Name: 1-(3-chlorophenyl)-3-(5-isoquinolyl)thiourea CAS Name: 1-(3-chlorophenyl)-3-(5-isoquinolinyl)thiourea IUPAC Name: 1-(3-chlorophenyl)-3-isoquinolin-5-ylthiourea Traditional Name: 1-(3-chlorophenyl)-3-(5-isoquinolyl)thiourea Formula: C16H12ClN3S MolecularWeight: 313.80458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)NC(=S)NC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

C1=CC(=CC(=C1)Cl)NC(=S)NC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C16H12ClN3S/c17-12-4-2-5-13(9-12)19-16(21)20-15-6-1-3-11-10-18-8-7-14(11)15/h1-10H,(H2,19,20,21)