1-isoquinolin-5-yl-3-[(4-methoxyphenyl)methyl]thiourea

Systemtic Name: 1-isoquinolin-5-yl-3-[(4-methoxyphenyl)methyl]thiourea Openeye Name: 1-(5-isoquinolyl)-3-[(4-methoxyphenyl)methyl]thiourea CAS Name: 1-(5-isoquinolinyl)-3-[(4-methoxyphenyl)methyl]thiourea IUPAC Name: 1-isoquinolin-5-yl-3-[(4-methoxyphenyl)methyl]thiourea Traditional Name: 1-(5-isoquinolyl)-3-p-anisyl-thiourea Formula: C18H17N3OS MolecularWeight: 323.41208

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CNC(=S)NC2=CC=CC3=C2C=CN=C3

Isomeric SMILES

COC1=CC=C(C=C1)CNC(=S)NC2=CC=CC3=C2C=CN=C3

InChI

InChI=1S/C18H17N3OS/c1-22-15-7-5-13(6-8-15)11-20-18(23)21-17-4-2-3-14-12-19-10-9-16(14)17/h2-10,12H,11H2,1H3,(H2,20,21,23)