3-(4-chloranyl-3-nitro-phenyl)-N-[4-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]prop-2-enamide

Systemtic Name: 3-(4-chloranyl-3-nitro-phenyl)-N-[4-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]prop-2-enamide Openeye Name: 3-(4-chloro-3-nitro-phenyl)-N-[4-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]prop-2-enamide CAS Name: 3-(4-chloro-3-nitrophenyl)-N-[4-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]-2-propenamide IUPAC Name: 3-(4-chloro-3-nitrophenyl)-N-[4-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]prop-2-enamide Traditional Name: 3-(4-chloro-3-nitro-phenyl)-N-[4-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)phenyl]acrylamide Formula: C20H15ClN6O3S MolecularWeight: 454.8895

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C2N1N=C(S2)C3=CC=C(C=C3)NC(=O)C=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CCC1=NN=C2N1N=C(S2)C3=CC=C(C=C3)NC(=O)C=CC4=CC(=C(C=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C20H15ClN6O3S/c1-2-17-23-24-20-26(17)25-19(31-20)13-5-7-14(8-6-13)22-18(28)10-4-12-3-9-15(21)16(11-12)27(29)30/h3-11H,2H2,1H3,(H,22,28)