1-(2,3-dimethylphenyl)-3-[[4-(3-methylbutoxy)phenyl]methylideneamino]thiourea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-[[4-(3-methylbutoxy)phenyl]methylideneamino]thiourea Openeye Name: 1-(2,3-dimethylphenyl)-3-[(4-isopentyloxyphenyl)methyleneamino]thiourea CAS Name: 1-(2,3-dimethylphenyl)-3-[[4-(3-methylbutoxy)phenyl]methylideneamino]thiourea IUPAC Name: 1-(2,3-dimethylphenyl)-3-[[4-(3-methylbutoxy)phenyl]methylideneamino]thiourea Traditional Name: 1-(2,3-dimethylphenyl)-3-[(4-isoamoxybenzylidene)amino]thiourea Formula: C21H27N3OS MolecularWeight: 369.52358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=S)NN=CC2=CC=C(C=C2)OCCC(C)C)C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=S)NN=CC2=CC=C(C=C2)OCCC(C)C)C

InChI

InChI=1S/C21H27N3OS/c1-15(2)12-13-25-19-10-8-18(9-11-19)14-22-24-21(26)23-20-7-5-6-16(3)17(20)4/h5-11,14-15H,12-13H2,1-4H3,(H2,23,24,26)