methyl (Z)-3-[[3-methyl-5-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]-1,2,3-triazol-4-yl]sulfanyl]prop-2-enoate

Systemtic Name: methyl (Z)-3-[[3-methyl-5-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]-1,2,3-triazol-4-yl]sulfanyl]prop-2-enoate Openeye Name: methyl (Z)-3-[3-methyl-5-[4-(2-nitrophenyl)thiazol-2-yl]triazol-4-yl]sulfanylprop-2-enoate CAS Name: (Z)-3-[[3-methyl-5-[4-(2-nitrophenyl)-2-thiazolyl]-4-triazolyl]thio]-2-propenoic acid methyl ester IUPAC Name: methyl (Z)-3-[3-methyl-5-[4-(2-nitrophenyl)-1,3-thiazol-2-yl]triazol-4-yl]sulfanylprop-2-enoate Traditional Name: (Z)-3-[[3-methyl-5-[4-(2-nitrophenyl)thiazol-2-yl]triazol-4-yl]thio]acrylic acid methyl ester Formula: C16H13N5O4S2 MolecularWeight: 403.43552

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(N=N1)C2=NC(=CS2)C3=CC=CC=C3[N+](=O)[O-])SC=CC(=O)OC

Isomeric SMILES

CN1C(=C(N=N1)C2=NC(=CS2)C3=CC=CC=C3[N+](=O)[O-])S/C=C\C(=O)OC

InChI

InChI=1S/C16H13N5O4S2/c1-20-16(26-8-7-13(22)25-2)14(18-19-20)15-17-11(9-27-15)10-5-3-4-6-12(10)21(23)24/h3-9H,1-2H3/b8-7-