3-cyano-N-[2-[4-[(3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridin-4-yl)carbonylsulfamoyl]phenyl]ethyl]-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxamide

Systemtic Name: 3-cyano-N-[2-[4-[(3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridin-4-yl)carbonylsulfamoyl]phenyl]ethyl]-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxamide Openeye Name: 3-cyano-N-[2-[4-[(3-cyano-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carbonyl)sulfamoyl]phenyl]ethyl]-6-cyclopropyl-2-methylsulfanyl-pyridine-4-carboxamide CAS Name: 3-cyano-N-[2-[4-[[[3-cyano-6-cyclopropyl-2-(methylthio)-4-pyridinyl]-oxomethyl]sulfamoyl]phenyl]ethyl]-6-cyclopropyl-2-(methylthio)-4-pyridinecarboxamide IUPAC Name: 3-cyano-N-[2-[4-[(3-cyano-6-cyclopropyl-2-methylsulfanylpyridine-4-carbonyl)sulfamoyl]phenyl]ethyl]-6-cyclopropyl-2-methylsulfanylpyridine-4-carboxamide Traditional Name: 3-cyano-N-[2-[4-[[3-cyano-6-cyclopropyl-2-(methylthio)isonicotinoyl]sulfamoyl]phenyl]ethyl]-6-cyclopropyl-2-(methylthio)isonicotinamide Formula: C30H28N6O4S3 MolecularWeight: 632.77612

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(=CC(=N1)C2CC2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)NC(=O)C4=CC(=NC(=C4C#N)SC)C5CC5)C#N

Isomeric SMILES

CSC1=C(C(=CC(=N1)C2CC2)C(=O)NCCC3=CC=C(C=C3)S(=O)(=O)NC(=O)C4=CC(=NC(=C4C#N)SC)C5CC5)C#N

InChI

InChI=1S/C30H28N6O4S3/c1-41-29-23(15-31)21(13-25(34-29)18-5-6-18)27(37)33-12-11-17-3-9-20(10-4-17)43(39,40)36-28(38)22-14-26(19-7-8-19)35-30(42-2)24(22)16-32/h3-4,9-10,13-14,18-19H,5-8,11-12H2,1-2H3,(H,33,37)(H,36,38)