N-[4-(cyanomethyl)phenyl]-1-(4-methylphenyl)sulfonyl-N-propan-2-ylsulfonyl-pyrrole-3-carboxamide

Systemtic Name: N-[4-(cyanomethyl)phenyl]-1-(4-methylphenyl)sulfonyl-N-propan-2-ylsulfonyl-pyrrole-3-carboxamide Openeye Name: N-[4-(cyanomethyl)phenyl]-N-isopropylsulfonyl-1-(p-tolylsulfonyl)pyrrole-3-carboxamide CAS Name: N-[4-(cyanomethyl)phenyl]-1-(4-methylphenyl)sulfonyl-N-propan-2-ylsulfonyl-3-pyrrolecarboxamide IUPAC Name: N-[4-(cyanomethyl)phenyl]-1-(4-methylphenyl)sulfonyl-N-propan-2-ylsulfonylpyrrole-3-carboxamide Traditional Name: N-[4-(cyanomethyl)phenyl]-N-isopropylsulfonyl-1-tosyl-pyrrole-3-carboxamide Formula: C23H23N3O5S2 MolecularWeight: 485.57582

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=O)N(C3=CC=C(C=C3)CC#N)S(=O)(=O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=O)N(C3=CC=C(C=C3)CC#N)S(=O)(=O)C(C)C

InChI

InChI=1S/C23H23N3O5S2/c1-17(2)32(28,29)26(21-8-6-19(7-9-21)12-14-24)23(27)20-13-15-25(16-20)33(30,31)22-10-4-18(3)5-11-22/h4-11,13,15-17H,12H2,1-3H3