1-[(3-chloranyl-5-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-cyclohexyl-thiourea

Systemtic Name: 1-[(3-chloranyl-5-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-cyclohexyl-thiourea Openeye Name: 1-[(3-chloro-5-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-cyclohexyl-thiourea CAS Name: 1-[(3-chloro-5-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-cyclohexylthiourea IUPAC Name: 1-[(3-chloro-5-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-cyclohexylthiourea Traditional Name: 1-[(3-chloro-5-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-cyclohexyl-thiourea Formula: C14H18ClN3O2S MolecularWeight: 327.82962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=S)NNC=C2C=C(C(=O)C(=C2)Cl)O

Isomeric SMILES

C1CCC(CC1)NC(=S)NNC=C2C=C(C(=O)C(=C2)Cl)O

InChI

InChI=1S/C14H18ClN3O2S/c15-11-6-9(7-12(19)13(11)20)8-16-18-14(21)17-10-4-2-1-3-5-10/h6-8,10,16,19H,1-5H2,(H2,17,18,21)