N-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)carbamothioyl]-4-morpholin-4-ylsulfonyl-benzamide

Systemtic Name: N-[(4-chloranyl-3-morpholin-4-ylsulfonyl-phenyl)carbamothioyl]-4-morpholin-4-ylsulfonyl-benzamide Openeye Name: N-[(4-chloro-3-morpholinosulfonyl-phenyl)carbamothioyl]-4-morpholinosulfonyl-benzamide CAS Name: N-[[4-chloro-3-(4-morpholinylsulfonyl)anilino]-sulfanylidenemethyl]-4-(4-morpholinylsulfonyl)benzamide IUPAC Name: N-[(4-chloro-3-morpholin-4-ylsulfonylphenyl)carbamothioyl]-4-morpholin-4-ylsulfonylbenzamide Traditional Name: N-[(4-chloro-3-morpholinosulfonyl-phenyl)thiocarbamoyl]-4-morpholinosulfonyl-benzamide Formula: C22H25ClN4O7S3 MolecularWeight: 589.1045

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC(=S)NC3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4

Isomeric SMILES

C1COCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC(=S)NC3=CC(=C(C=C3)Cl)S(=O)(=O)N4CCOCC4

InChI

InChI=1S/C22H25ClN4O7S3/c23-19-6-3-17(15-20(19)37(31,32)27-9-13-34-14-10-27)24-22(35)25-21(28)16-1-4-18(5-2-16)36(29,30)26-7-11-33-12-8-26/h1-6,15H,7-14H2,(H2,24,25,28,35)