1-isoquinolin-5-yl-3-(2-methoxyphenyl)thiourea

Systemtic Name: 1-isoquinolin-5-yl-3-(2-methoxyphenyl)thiourea Openeye Name: 1-(5-isoquinolyl)-3-(2-methoxyphenyl)thiourea CAS Name: 1-(5-isoquinolinyl)-3-(2-methoxyphenyl)thiourea IUPAC Name: 1-isoquinolin-5-yl-3-(2-methoxyphenyl)thiourea Traditional Name: 1-(5-isoquinolyl)-3-(2-methoxyphenyl)thiourea Formula: C17H15N3OS MolecularWeight: 309.3855

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1NC(=S)NC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

COC1=CC=CC=C1NC(=S)NC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C17H15N3OS/c1-21-16-8-3-2-6-15(16)20-17(22)19-14-7-4-5-12-11-18-10-9-13(12)14/h2-11H,1H3,(H2,19,20,22)