3-(4-chloranyl-3-nitro-phenyl)-N-(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)prop-2-enamide

Systemtic Name: 3-(4-chloranyl-3-nitro-phenyl)-N-(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)prop-2-enamide Openeye Name: 3-(4-chloro-3-nitro-phenyl)-N-(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)prop-2-enamide CAS Name: 3-(4-chloro-3-nitrophenyl)-N-[3-(ethylthio)-5-methyl-1,2,4-triazol-4-yl]-2-propenamide IUPAC Name: 3-(4-chloro-3-nitrophenyl)-N-(3-ethylsulfanyl-5-methyl-1,2,4-triazol-4-yl)prop-2-enamide Traditional Name: 3-(4-chloro-3-nitro-phenyl)-N-[3-(ethylthio)-5-methyl-1,2,4-triazol-4-yl]acrylamide Formula: C14H14ClN5O3S MolecularWeight: 367.81066

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1NC(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CCSC1=NN=C(N1NC(=O)C=CC2=CC(=C(C=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C14H14ClN5O3S/c1-3-24-14-17-16-9(2)19(14)18-13(21)7-5-10-4-6-11(15)12(8-10)20(22)23/h4-8H,3H2,1-2H3,(H,18,21)