1-(3-methoxyphenyl)-3-[4-[(phenylmethyl)sulfamoyl]phenyl]thiourea

Systemtic Name: 1-(3-methoxyphenyl)-3-[4-[(phenylmethyl)sulfamoyl]phenyl]thiourea Openeye Name: 1-[4-(benzylsulfamoyl)phenyl]-3-(3-methoxyphenyl)thiourea CAS Name: 1-(3-methoxyphenyl)-3-[4-[(phenylmethyl)sulfamoyl]phenyl]thiourea IUPAC Name: 1-[4-(benzylsulfamoyl)phenyl]-3-(3-methoxyphenyl)thiourea Traditional Name: 1-[4-(benzylsulfamoyl)phenyl]-3-(3-methoxyphenyl)thiourea Formula: C21H21N3O3S2 MolecularWeight: 427.53974

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=S)NC2=CC=C(C=C2)S(=O)(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O3S2/c1-27-19-9-5-8-18(14-19)24-21(28)23-17-10-12-20(13-11-17)29(25,26)22-15-16-6-3-2-4-7-16/h2-14,22H,15H2,1H3,(H2,23,24,28)