1-(3-chloranyl-2-methyl-phenyl)-3-[1-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[1-(2-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[1-(2-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[1-(2-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)ethylamino]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[1-(2-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[1-(2-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Formula: C16H16ClN3O2S MolecularWeight: 349.83514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC(=C2C=CC(=O)C=C2O)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC(=C2C=CC(=O)C=C2O)C

InChI

InChI=1S/C16H16ClN3O2S/c1-9-13(17)4-3-5-14(9)18-16(23)20-19-10(2)12-7-6-11(21)8-15(12)22/h3-8,19,22H,1-2H3,(H2,18,20,23)