1-[(4-sulfamoylphenyl)methyl]-3-(3,4,5-trimethoxyphenyl)thiourea

Systemtic Name: 1-[(4-sulfamoylphenyl)methyl]-3-(3,4,5-trimethoxyphenyl)thiourea Openeye Name: 1-[(4-sulfamoylphenyl)methyl]-3-(3,4,5-trimethoxyphenyl)thiourea CAS Name: 1-[(4-sulfamoylphenyl)methyl]-3-(3,4,5-trimethoxyphenyl)thiourea IUPAC Name: 1-[(4-sulfamoylphenyl)methyl]-3-(3,4,5-trimethoxyphenyl)thiourea Traditional Name: 1-(4-sulfamoylbenzyl)-3-(3,4,5-trimethoxyphenyl)thiourea Formula: C17H21N3O5S2 MolecularWeight: 411.49574

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC(=S)NCC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC(=S)NCC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C17H21N3O5S2/c1-23-14-8-12(9-15(24-2)16(14)25-3)20-17(26)19-10-11-4-6-13(7-5-11)27(18,21)22/h4-9H,10H2,1-3H3,(H2,18,21,22)(H2,19,20,26)