1-(2,4-dichlorophenyl)-3-[phenyl-[(E)-phenylsulfonylmethylideneamino]methyl]thiourea

Systemtic Name: 1-(2,4-dichlorophenyl)-3-[phenyl-[(E)-phenylsulfonylmethylideneamino]methyl]thiourea Openeye Name: 1-[[(E)-benzenesulfonylmethyleneamino]-phenyl-methyl]-3-(2,4-dichlorophenyl)thiourea CAS Name: 1-[[(E)-benzenesulfonylmethylideneamino]-phenylmethyl]-3-(2,4-dichlorophenyl)thiourea IUPAC Name: 1-[[(E)-benzenesulfonylmethylideneamino]-phenylmethyl]-3-(2,4-dichlorophenyl)thiourea Traditional Name: 1-[[(E)-besylmethyleneamino]-phenyl-methyl]-3-(2,4-dichlorophenyl)thiourea Formula: C21H17Cl2N3O2S2 MolecularWeight: 478.41458

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(NC(=S)NC2=C(C=C(C=C2)Cl)Cl)N=CS(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(NC(=S)NC2=C(C=C(C=C2)Cl)Cl)/N=C/S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H17Cl2N3O2S2/c22-16-11-12-19(18(23)13-16)25-21(29)26-20(15-7-3-1-4-8-15)24-14-30(27,28)17-9-5-2-6-10-17/h1-14,20H,(H2,25,26,29)/b24-14+