4-[5-(2,4-dinitrophenyl)sulfanyl-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 4-[5-(2,4-dinitrophenyl)sulfanyl-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-(2,4-dinitrophenyl)sulfanyl-4-(2-furylmethyl)-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[5-[(2,4-dinitrophenyl)thio]-4-(2-furanylmethyl)-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[5-(2,4-dinitrophenyl)sulfanyl-4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[5-[(2,4-dinitrophenyl)thio]-4-(2-furfuryl)-1,2,4-triazol-3-yl]pyridine Formula: C18H12N6O5S MolecularWeight: 424.39008

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Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=C1)CN2C(=NN=C2SC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=NC=C4

Isomeric SMILES

C1=COC(=C1)CN2C(=NN=C2SC3=C(C=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C4=CC=NC=C4

InChI

InChI=1S/C18H12N6O5S/c25-23(26)13-3-4-16(15(10-13)24(27)28)30-18-21-20-17(12-5-7-19-8-6-12)22(18)11-14-2-1-9-29-14/h1-10H,11H2