1-butyl-3-[(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea

Systemtic Name: 1-butyl-3-[(3,5-dimethyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Openeye Name: 1-butyl-3-[(3,5-dimethyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea CAS Name: 1-butyl-3-[(3,5-dimethyl-4-oxo-1-cyclohexa-2,5-dienylidene)methylamino]thiourea IUPAC Name: 1-butyl-3-[(3,5-dimethyl-4-oxocyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Traditional Name: 1-butyl-3-[(4-keto-3,5-dimethyl-cyclohexa-2,5-dien-1-ylidene)methylamino]thiourea Formula: C14H21N3OS MolecularWeight: 279.40104

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H21N3OS/c1-4-5-6-15-14(19)17-16-9-12-7-10(2)13(18)11(3)8-12/h7-9,16H,4-6H2,1-3H3,(H2,15,17,19)