N-[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methyl-phenyl]-3-(3-nitrophenyl)prop-2-enamide

Systemtic Name: N-[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methyl-phenyl]-3-(3-nitrophenyl)prop-2-enamide Openeye Name: N-[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methyl-phenyl]-3-(3-nitrophenyl)prop-2-enamide CAS Name: N-[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylphenyl]-3-(3-nitrophenyl)-2-propenamide IUPAC Name: N-[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methylphenyl]-3-(3-nitrophenyl)prop-2-enamide Traditional Name: N-[5-(3-ethyl-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)-2-methyl-phenyl]-3-(3-nitrophenyl)acrylamide Formula: C21H18N6O3S MolecularWeight: 434.47102

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N6O3S/c1-3-18-23-24-21-26(18)25-20(31-21)15-9-7-13(2)17(12-15)22-19(28)10-8-14-5-4-6-16(11-14)27(29)30/h4-12H,3H2,1-2H3,(H,22,28)