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

Systemtic Name: 1-(3,4-dimethoxyphenyl)-3-[[4-(3-methylbutoxy)phenyl]methylideneamino]thiourea Openeye Name: 1-(3,4-dimethoxyphenyl)-3-[(4-isopentyloxyphenyl)methyleneamino]thiourea CAS Name: 1-(3,4-dimethoxyphenyl)-3-[[4-(3-methylbutoxy)phenyl]methylideneamino]thiourea IUPAC Name: 1-(3,4-dimethoxyphenyl)-3-[[4-(3-methylbutoxy)phenyl]methylideneamino]thiourea Traditional Name: 1-(3,4-dimethoxyphenyl)-3-[(4-isoamoxybenzylidene)amino]thiourea Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C=NNC(=S)NC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)C=NNC(=S)NC2=CC(=C(C=C2)OC)OC

InChI

InChI=1S/C21H27N3O3S/c1-15(2)11-12-27-18-8-5-16(6-9-18)14-22-24-21(28)23-17-7-10-19(25-3)20(13-17)26-4/h5-10,13-15H,11-12H2,1-4H3,(H2,23,24,28)