1-butyl-3-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea

Systemtic Name: 1-butyl-3-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Openeye Name: 1-butyl-3-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea CAS Name: 1-butyl-3-[1-(4-oxo-1-cyclohexa-2,5-dienylidene)ethylamino]thiourea IUPAC Name: 1-butyl-3-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Traditional Name: 1-butyl-3-[1-(4-ketocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Formula: C13H19N3OS MolecularWeight: 265.37446

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NNC(=C1C=CC(=O)C=C1)C

Isomeric SMILES

CCCCNC(=S)NNC(=C1C=CC(=O)C=C1)C

InChI

InChI=1S/C13H19N3OS/c1-3-4-9-14-13(18)16-15-10(2)11-5-7-12(17)8-6-11/h5-8,15H,3-4,9H2,1-2H3,(H2,14,16,18)