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

Systemtic Name: (E)-3-[5-(5-chloranylindol-1-yl)-1,3-dimethyl-pyrazol-4-yl]-N-pentylsulfonyl-prop-2-enamide Openeye Name: (E)-3-[5-(5-chloroindol-1-yl)-1,3-dimethyl-pyrazol-4-yl]-N-pentylsulfonyl-prop-2-enamide CAS Name: (E)-3-[5-(5-chloro-1-indolyl)-1,3-dimethyl-4-pyrazolyl]-N-pentylsulfonyl-2-propenamide IUPAC Name: (E)-3-[5-(5-chloroindol-1-yl)-1,3-dimethylpyrazol-4-yl]-N-pentylsulfonylprop-2-enamide Traditional Name: (E)-N-amylsulfonyl-3-[5-(5-chloroindol-1-yl)-1,3-dimethyl-pyrazol-4-yl]acrylamide Formula: C21H25ClN4O3S MolecularWeight: 448.9662

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)NC(=O)C=CC1=C(N(N=C1C)C)N2C=CC3=C2C=CC(=C3)Cl

Isomeric SMILES

CCCCCS(=O)(=O)NC(=O)/C=C/C1=C(N(N=C1C)C)N2C=CC3=C2C=CC(=C3)Cl

InChI

InChI=1S/C21H25ClN4O3S/c1-4-5-6-13-30(28,29)24-20(27)10-8-18-15(2)23-25(3)21(18)26-12-11-16-14-17(22)7-9-19(16)26/h7-12,14H,4-6,13H2,1-3H3,(H,24,27)/b10-8+