1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-3-(4-morpholin-4-ylsulfonylphenyl)thiourea

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-3-(4-morpholinosulfonylphenyl)thiourea CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-3-[4-(4-morpholinylsulfonyl)phenyl]thiourea IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-1-methyl-3-(4-morpholin-4-ylsulfonylphenyl)thiourea Traditional Name: 1-homoveratryl-1-methyl-3-(4-morpholinosulfonylphenyl)thiourea Formula: C22H29N3O5S2 MolecularWeight: 479.61276

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC(=C(C=C1)OC)OC)C(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CN(CCC1=CC(=C(C=C1)OC)OC)C(=S)NC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H29N3O5S2/c1-24(11-10-17-4-9-20(28-2)21(16-17)29-3)22(31)23-18-5-7-19(8-6-18)32(26,27)25-12-14-30-15-13-25/h4-9,16H,10-15H2,1-3H3,(H,23,31)