1-[[(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-phenyl-methyl]amino]thiourea

Systemtic Name: 1-[[(3,5-ditert-butyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-phenyl-methyl]amino]thiourea Openeye Name: [[(3,5-ditert-butyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-phenyl-methyl]amino]thiourea CAS Name: [[(3,5-ditert-butyl-4-oxo-1-cyclohexa-2,5-dienylidene)-phenylmethyl]amino]thiourea IUPAC Name: [[(3,5-ditert-butyl-4-oxocyclohexa-2,5-dien-1-ylidene)-phenylmethyl]amino]thiourea Traditional Name: [[(3,5-ditert-butyl-4-keto-cyclohexa-2,5-dien-1-ylidene)-phenyl-methyl]amino]thiourea Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C2=CC=CC=C2)NNC(=S)N)C=C(C1=O)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C2=CC=CC=C2)NNC(=S)N)C=C(C1=O)C(C)(C)C

InChI

InChI=1S/C22H29N3OS/c1-21(2,3)16-12-15(13-17(19(16)26)22(4,5)6)18(24-25-20(23)27)14-10-8-7-9-11-14/h7-13,24H,1-6H3,(H3,23,25,27)