1-(2-ethyl-6-methyl-phenyl)-3-[2-(4-oxidanylidenecinnolin-1-yl)ethanoylamino]thiourea

Systemtic Name: 1-(2-ethyl-6-methyl-phenyl)-3-[2-(4-oxidanylidenecinnolin-1-yl)ethanoylamino]thiourea Openeye Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[2-(4-oxocinnolin-1-yl)acetyl]amino]thiourea CAS Name: 1-(2-ethyl-6-methylphenyl)-3-[[1-oxo-2-(4-oxo-1-cinnolinyl)ethyl]amino]thiourea IUPAC Name: 1-(2-ethyl-6-methylphenyl)-3-[[2-(4-oxocinnolin-1-yl)acetyl]amino]thiourea Traditional Name: 1-(2-ethyl-6-methyl-phenyl)-3-[[2-(4-ketocinnolin-1-yl)acetyl]amino]thiourea Formula: C20H21N5O2S MolecularWeight: 395.47804

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NNC(=O)CN2C3=CC=CC=C3C(=O)C=N2)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NNC(=O)CN2C3=CC=CC=C3C(=O)C=N2)C

InChI

InChI=1S/C20H21N5O2S/c1-3-14-8-6-7-13(2)19(14)22-20(28)24-23-18(27)12-25-16-10-5-4-9-15(16)17(26)11-21-25/h4-11H,3,12H2,1-2H3,(H,23,27)(H2,22,24,28)