(E)-3-(1,3-dimethyl-5-pyrrolo[2,3-b]pyridin-1-yl-pyrazol-4-yl)-N-pentylsulfonyl-prop-2-enamide

Systemtic Name: (E)-3-(1,3-dimethyl-5-pyrrolo[2,3-b]pyridin-1-yl-pyrazol-4-yl)-N-pentylsulfonyl-prop-2-enamide Openeye Name: (E)-3-(1,3-dimethyl-5-pyrrolo[2,3-b]pyridin-1-yl-pyrazol-4-yl)-N-pentylsulfonyl-prop-2-enamide CAS Name: (E)-3-[1,3-dimethyl-5-(1-pyrrolo[2,3-b]pyridinyl)-4-pyrazolyl]-N-pentylsulfonyl-2-propenamide IUPAC Name: (E)-3-(1,3-dimethyl-5-pyrrolo[2,3-b]pyridin-1-ylpyrazol-4-yl)-N-pentylsulfonylprop-2-enamide Traditional Name: (E)-N-amylsulfonyl-3-(1,3-dimethyl-5-pyrrolo[2,3-b]pyridin-1-yl-pyrazol-4-yl)acrylamide Formula: C20H25N5O3S MolecularWeight: 415.5092

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)NC(=O)C=CC1=C(N(N=C1C)C)N2C=CC3=C2N=CC=C3

Isomeric SMILES

CCCCCS(=O)(=O)NC(=O)/C=C/C1=C(N(N=C1C)C)N2C=CC3=C2N=CC=C3

InChI

InChI=1S/C20H25N5O3S/c1-4-5-6-14-29(27,28)23-18(26)10-9-17-15(2)22-24(3)20(17)25-13-11-16-8-7-12-21-19(16)25/h7-13H,4-6,14H2,1-3H3,(H,23,26)/b10-9+