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

Systemtic Name: 1-[(3-chloranyl-5-oxidanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Openeye Name: 1-[(3-chloro-5-hydroxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea CAS Name: 1-[(3-chloro-5-hydroxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea IUPAC Name: 1-[(3-chloro-5-hydroxy-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Traditional Name: 1-[(3-chloro-5-hydroxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methylamino]-3-[(1S,2S)-2-methylcyclohexyl]thiourea Formula: C15H20ClN3O2S MolecularWeight: 341.8562

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCC1NC(=S)NNC=C2C=C(C(=O)C(=C2)Cl)O

Isomeric SMILES

C[C@H]1CCCC[C@@H]1NC(=S)NNC=C2C=C(C(=O)C(=C2)Cl)O

InChI

InChI=1S/C15H20ClN3O2S/c1-9-4-2-3-5-12(9)18-15(22)19-17-8-10-6-11(16)14(21)13(20)7-10/h6-9,12,17,20H,2-5H2,1H3,(H2,18,19,22)/t9-,12-/m0/s1