(E)-N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(1-methylpyrazol-4-yl)prop-2-enamide

Systemtic Name: (E)-N-[5-chloranyl-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(1-methylpyrazol-4-yl)prop-2-enamide Openeye Name: (E)-N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(1-methylpyrazol-4-yl)prop-2-enamide CAS Name: (E)-N-[5-chloro-2-(4-ethyl-1-piperazin-4-iumyl)phenyl]-3-(1-methyl-4-pyrazolyl)-2-propenamide IUPAC Name: (E)-N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(1-methylpyrazol-4-yl)prop-2-enamide Traditional Name: (E)-N-[5-chloro-2-(4-ethylpiperazin-4-ium-1-yl)phenyl]-3-(1-methylpyrazol-4-yl)acrylamide Formula: C19H25ClN5O+ MolecularWeight: 374.8877

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)C=CC3=CN(N=C3)C

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=C(C=C(C=C2)Cl)NC(=O)/C=C/C3=CN(N=C3)C

InChI

InChI=1S/C19H24ClN5O/c1-3-24-8-10-25(11-9-24)18-6-5-16(20)12-17(18)22-19(26)7-4-15-13-21-23(2)14-15/h4-7,12-14H,3,8-11H2,1-2H3,(H,22,26)/p+1/b7-4+