1-(3-chloranyl-2-methyl-phenyl)-3-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]thiourea

Systemtic Name: 1-(3-chloranyl-2-methyl-phenyl)-3-[(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Openeye Name: 1-(3-chloro-2-methyl-phenyl)-3-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]thiourea CAS Name: 1-(3-chloro-2-methylphenyl)-3-[(4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]thiourea IUPAC Name: 1-(3-chloro-2-methylphenyl)-3-[(4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Traditional Name: 1-(3-chloro-2-methyl-phenyl)-3-[(4-ketocyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Formula: C15H14ClN3OS MolecularWeight: 319.80916

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=S)NNC=C2C=CC(=O)C=C2

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=S)NNC=C2C=CC(=O)C=C2

InChI

InChI=1S/C15H14ClN3OS/c1-10-13(16)3-2-4-14(10)18-15(21)19-17-9-11-5-7-12(20)8-6-11/h2-9,17H,1H3,(H2,18,19,21)