1-(4-chlorophenyl)-3-[2-(4-oxidanylidenecinnolin-1-yl)ethanoylamino]thiourea

Systemtic Name: 1-(4-chlorophenyl)-3-[2-(4-oxidanylidenecinnolin-1-yl)ethanoylamino]thiourea Openeye Name: 1-(4-chlorophenyl)-3-[[2-(4-oxocinnolin-1-yl)acetyl]amino]thiourea CAS Name: 1-(4-chlorophenyl)-3-[[1-oxo-2-(4-oxo-1-cinnolinyl)ethyl]amino]thiourea IUPAC Name: 1-(4-chlorophenyl)-3-[[2-(4-oxocinnolin-1-yl)acetyl]amino]thiourea Traditional Name: 1-(4-chlorophenyl)-3-[[2-(4-ketocinnolin-1-yl)acetyl]amino]thiourea Formula: C17H14ClN5O2S MolecularWeight: 387.84336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C=NN2CC(=O)NNC(=S)NC3=CC=C(C=C3)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C=NN2CC(=O)NNC(=S)NC3=CC=C(C=C3)Cl

InChI

InChI=1S/C17H14ClN5O2S/c18-11-5-7-12(8-6-11)20-17(26)22-21-16(25)10-23-14-4-2-1-3-13(14)15(24)9-19-23/h1-9H,10H2,(H,21,25)(H2,20,22,26)