3-[5-(diethylsulfamoyl)-2-methyl-phenyl]-1-[(3-methoxyphenyl)methyl]-1-methyl-thiourea

Systemtic Name: 3-[5-(diethylsulfamoyl)-2-methyl-phenyl]-1-[(3-methoxyphenyl)methyl]-1-methyl-thiourea Openeye Name: 3-[5-(diethylsulfamoyl)-2-methyl-phenyl]-1-[(3-methoxyphenyl)methyl]-1-methyl-thiourea CAS Name: 3-[5-(diethylsulfamoyl)-2-methylphenyl]-1-[(3-methoxyphenyl)methyl]-1-methylthiourea IUPAC Name: 3-[5-(diethylsulfamoyl)-2-methylphenyl]-1-[(3-methoxyphenyl)methyl]-1-methylthiourea Traditional Name: 3-[5-(diethylsulfamoyl)-2-methyl-phenyl]-1-m-anisyl-1-methyl-thiourea Formula: C21H29N3O3S2 MolecularWeight: 435.60326

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=S)N(C)CC2=CC(=CC=C2)OC

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC(=C(C=C1)C)NC(=S)N(C)CC2=CC(=CC=C2)OC

InChI

InChI=1S/C21H29N3O3S2/c1-6-24(7-2)29(25,26)19-12-11-16(3)20(14-19)22-21(28)23(4)15-17-9-8-10-18(13-17)27-5/h8-14H,6-7,15H2,1-5H3,(H,22,28)