1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(2-methyl-2-phenyl-propanoyl)amino]thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(2-methyl-2-phenyl-propanoyl)amino]thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(2-methyl-2-phenyl-propanoyl)amino]thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(2-methyl-1-oxo-2-phenylpropyl)amino]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-3-[(2-methyl-2-phenylpropanoyl)amino]thiourea Traditional Name: 1-homoveratryl-3-[(2-methyl-2-phenyl-propanoyl)amino]thiourea Formula: C21H27N3O3S MolecularWeight: 401.52238

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C1=CC=CC=C1)C(=O)NNC(=S)NCCC2=CC(=C(C=C2)OC)OC

Isomeric SMILES

CC(C)(C1=CC=CC=C1)C(=O)NNC(=S)NCCC2=CC(=C(C=C2)OC)OC

InChI

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