N-[(2,4-dichlorophenyl)methylcarbamothioyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[(2,4-dichlorophenyl)methylcarbamothioyl]-2-methyl-5-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[(2,4-dichlorophenyl)methylcarbamothioyl]-2-methyl-5-morpholinosulfonyl-benzamide CAS Name: N-[[(2,4-dichlorophenyl)methylamino]-sulfanylidenemethyl]-2-methyl-5-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[(2,4-dichlorophenyl)methylcarbamothioyl]-2-methyl-5-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[(2,4-dichlorobenzyl)thiocarbamoyl]-2-methyl-5-morpholinosulfonyl-benzamide Formula: C20H21Cl2N3O4S2 MolecularWeight: 502.43444

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC(=S)NCC3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N2CCOCC2)C(=O)NC(=S)NCC3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C20H21Cl2N3O4S2/c1-13-2-5-16(31(27,28)25-6-8-29-9-7-25)11-17(13)19(26)24-20(30)23-12-14-3-4-15(21)10-18(14)22/h2-5,10-11H,6-9,12H2,1H3,(H2,23,24,26,30)