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

Systemtic Name: 1-[(3-chloranyl-5-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(furan-2-ylmethyl)thiourea Openeye Name: 1-[(3-chloro-5-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-furylmethyl)thiourea CAS Name: 1-[(3-chloro-5-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-(2-furanylmethyl)thiourea IUPAC Name: 1-[(3-chloro-5-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-(furan-2-ylmethyl)thiourea Traditional Name: 1-[(3-chloro-5-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-(2-furfuryl)thiourea Formula: C13H12ClN3O3S MolecularWeight: 325.77068

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CNC(=S)NNC=C2C=C(C(=O)C(=C2)Cl)O

Isomeric SMILES

C1=COC(=C1)CNC(=S)NNC=C2C=C(C(=O)C(=C2)Cl)O

InChI

InChI=1S/C13H12ClN3O3S/c14-10-4-8(5-11(18)12(10)19)6-16-17-13(21)15-7-9-2-1-3-20-9/h1-6,16,18H,7H2,(H2,15,17,21)