N-[[(2,5-dimethylphenyl)sulfonylamino]carbamothioyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide

Systemtic Name: N-[[(2,5-dimethylphenyl)sulfonylamino]carbamothioyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide Openeye Name: N-[[(2,5-dimethylphenyl)sulfonylamino]carbamothioyl]-3-(4-morpholinosulfonylphenyl)prop-2-enamide CAS Name: N-[[(2,5-dimethylphenyl)sulfonylhydrazo]-sulfanylidenemethyl]-3-[4-(4-morpholinylsulfonyl)phenyl]-2-propenamide IUPAC Name: N-[[(2,5-dimethylphenyl)sulfonylamino]carbamothioyl]-3-(4-morpholin-4-ylsulfonylphenyl)prop-2-enamide Traditional Name: N-[[(2,5-dimethylphenyl)sulfonylamino]thiocarbamoyl]-3-(4-morpholinosulfonylphenyl)acrylamide Formula: C22H26N4O6S3 MolecularWeight: 538.66004

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NNC(=S)NC(=O)C=CC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NNC(=S)NC(=O)C=CC2=CC=C(C=C2)S(=O)(=O)N3CCOCC3

InChI

InChI=1S/C22H26N4O6S3/c1-16-3-4-17(2)20(15-16)34(28,29)25-24-22(33)23-21(27)10-7-18-5-8-19(9-6-18)35(30,31)26-11-13-32-14-12-26/h3-10,15,25H,11-14H2,1-2H3,(H2,23,24,27,33)