1-methyl-3-[3-[3-(methylcarbamothioylamino)phenyl]sulfonylphenyl]thiourea

Systemtic Name: 1-methyl-3-[3-[3-(methylcarbamothioylamino)phenyl]sulfonylphenyl]thiourea Openeye Name: 1-methyl-3-[3-[3-(methylcarbamothioylamino)phenyl]sulfonylphenyl]thiourea CAS Name: 1-methyl-3-[3-[3-[[methylamino(sulfanylidene)methyl]amino]phenyl]sulfonylphenyl]thiourea IUPAC Name: 1-methyl-3-[3-[3-(methylcarbamothioylamino)phenyl]sulfonylphenyl]thiourea Traditional Name: 1-methyl-3-[3-[3-(methylthiocarbamoylamino)phenyl]sulfonylphenyl]thiourea Formula: C16H18N4O2S3 MolecularWeight: 394.53472

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NC1=CC(=CC=C1)S(=O)(=O)C2=CC=CC(=C2)NC(=S)NC

Isomeric SMILES

CNC(=S)NC1=CC(=CC=C1)S(=O)(=O)C2=CC=CC(=C2)NC(=S)NC

InChI

InChI=1S/C16H18N4O2S3/c1-17-15(23)19-11-5-3-7-13(9-11)25(21,22)14-8-4-6-12(10-14)20-16(24)18-2/h3-10H,1-2H3,(H2,17,19,23)(H2,18,20,24)