N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1-(4-methylphenyl)sulfonyl-N-prop-2-ynyl-pyrrole-3-carboxamide

Systemtic Name: N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1-(4-methylphenyl)sulfonyl-N-prop-2-ynyl-pyrrole-3-carboxamide Openeye Name: N-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-prop-2-ynyl-1-(p-tolylsulfonyl)pyrrole-3-carboxamide CAS Name: N-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-1-(4-methylphenyl)sulfonyl-N-prop-2-ynyl-3-pyrrolecarboxamide IUPAC Name: N-[(3,5-dimethyl-1,2-oxazol-4-yl)sulfonyl]-1-(4-methylphenyl)sulfonyl-N-prop-2-ynylpyrrole-3-carboxamide Traditional Name: N-(3,5-dimethylisoxazol-4-yl)sulfonyl-N-propargyl-1-tosyl-pyrrole-3-carboxamide Formula: C20H19N3O6S2 MolecularWeight: 461.51136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=O)N(CC#C)S(=O)(=O)C3=C(ON=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2C=CC(=C2)C(=O)N(CC#C)S(=O)(=O)C3=C(ON=C3C)C

InChI

InChI=1S/C20H19N3O6S2/c1-5-11-23(31(27,28)19-15(3)21-29-16(19)4)20(24)17-10-12-22(13-17)30(25,26)18-8-6-14(2)7-9-18/h1,6-10,12-13H,11H2,2-4H3