1-(2,6-dimethylphenyl)-3-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea

Systemtic Name: 1-(2,6-dimethylphenyl)-3-[1-(4-oxidanylidenecyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Openeye Name: 1-(2,6-dimethylphenyl)-3-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea CAS Name: 1-(2,6-dimethylphenyl)-3-[1-(4-oxo-1-cyclohexa-2,5-dienylidene)ethylamino]thiourea IUPAC Name: 1-(2,6-dimethylphenyl)-3-[1-(4-oxocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Traditional Name: 1-(2,6-dimethylphenyl)-3-[1-(4-ketocyclohexa-2,5-dien-1-ylidene)ethylamino]thiourea Formula: C17H19N3OS MolecularWeight: 313.41726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=S)NNC(=C2C=CC(=O)C=C2)C

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=S)NNC(=C2C=CC(=O)C=C2)C

InChI

InChI=1S/C17H19N3OS/c1-11-5-4-6-12(2)16(11)18-17(22)20-19-13(3)14-7-9-15(21)10-8-14/h4-10,19H,1-3H3,(H2,18,20,22)