[2-[[3,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-methyl-N-phenyl-piperazine-1-carboximidothioate

Systemtic Name: [2-[[3,5-bis(chloranyl)phenyl]amino]-2-oxidanylidene-ethyl] 4-methyl-N-phenyl-piperazine-1-carboximidothioate Openeye Name: [2-(3,5-dichloroanilino)-2-oxo-ethyl] 4-methyl-N-phenyl-piperazine-1-carboximidothioate CAS Name: 4-methyl-N-phenyl-1-piperazinecarboximidothioic acid [2-(3,5-dichloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3,5-dichloroanilino)-2-oxoethyl] 4-methyl-N-phenylpiperazine-1-carboximidothioate Traditional Name: 4-methyl-N-phenyl-piperazine-1-carboximidothioic acid [2-(3,5-dichloroanilino)-2-keto-ethyl] ester Formula: C20H22Cl2N4OS MolecularWeight: 437.38588

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=NC2=CC=CC=C2)SCC(=O)NC3=CC(=CC(=C3)Cl)Cl

Isomeric SMILES

CN1CCN(CC1)C(=NC2=CC=CC=C2)SCC(=O)NC3=CC(=CC(=C3)Cl)Cl

InChI

InChI=1S/C20H22Cl2N4OS/c1-25-7-9-26(10-8-25)20(24-17-5-3-2-4-6-17)28-14-19(27)23-18-12-15(21)11-16(22)13-18/h2-6,11-13H,7-10,14H2,1H3,(H,23,27)