1-(6,7-dimethoxyquinolin-4-yl)-1-(6-oxidanylidenecyclohexa-1,3-dien-1-yl)thiourea

Systemtic Name: 1-(6,7-dimethoxyquinolin-4-yl)-1-(6-oxidanylidenecyclohexa-1,3-dien-1-yl)thiourea Openeye Name: 1-(6,7-dimethoxy-4-quinolyl)-1-(6-oxocyclohexa-1,3-dien-1-yl)thiourea CAS Name: 1-(6,7-dimethoxy-4-quinolinyl)-1-(6-oxo-1-cyclohexa-1,3-dienyl)thiourea IUPAC Name: 1-(6,7-dimethoxyquinolin-4-yl)-1-(6-oxocyclohexa-1,3-dien-1-yl)thiourea Traditional Name: 1-(6,7-dimethoxy-4-quinolyl)-1-(6-ketocyclohexa-1,3-dien-1-yl)thiourea Formula: C18H17N3O3S MolecularWeight: 355.41088

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1OC)N(C3=CC=CCC3=O)C(=S)N

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1OC)N(C3=CC=CCC3=O)C(=S)N

InChI

InChI=1S/C18H17N3O3S/c1-23-16-9-11-12(10-17(16)24-2)20-8-7-13(11)21(18(19)25)14-5-3-4-6-15(14)22/h3-5,7-10H,6H2,1-2H3,(H2,19,25)