1-[4-[(5-bromanyl-3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]thiourea

Systemtic Name: 1-[4-[(5-bromanyl-3-chloranyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]thiourea Openeye Name: [4-[(5-bromo-3-chloro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]thiourea CAS Name: [4-[(5-bromo-3-chloro-6-oxo-1-cyclohexa-2,4-dienylidene)methylamino]phenyl]thiourea IUPAC Name: [4-[(5-bromo-3-chloro-6-oxocyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]thiourea Traditional Name: [4-[(5-bromo-3-chloro-6-keto-cyclohexa-2,4-dien-1-ylidene)methylamino]phenyl]thiourea Formula: C14H11BrClN3OS MolecularWeight: 384.67864

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC=C2C=C(C=C(C2=O)Br)Cl)NC(=S)N

Isomeric SMILES

C1=CC(=CC=C1NC=C2C=C(C=C(C2=O)Br)Cl)NC(=S)N

InChI

InChI=1S/C14H11BrClN3OS/c15-12-6-9(16)5-8(13(12)20)7-18-10-1-3-11(4-2-10)19-14(17)21/h1-7,18H,(H3,17,19,21)