3-[4-cyclopropyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine

Systemtic Name: 3-[4-cyclopropyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 3-[5-[(E)-cinnamyl]sulfanyl-4-cyclopropyl-1,2,4-triazol-3-yl]pyridine CAS Name: 3-[4-cyclopropyl-5-[[(E)-3-phenylprop-2-enyl]thio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 3-[4-cyclopropyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 3-[5-[[(E)-cinnamyl]thio]-4-cyclopropyl-1,2,4-triazol-3-yl]pyridine Formula: C19H18N4S MolecularWeight: 334.43802

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC=CC3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

C1CC1N2C(=NN=C2SC/C=C/C3=CC=CC=C3)C4=CN=CC=C4

InChI

InChI=1S/C19H18N4S/c1-2-6-15(7-3-1)8-5-13-24-19-22-21-18(23(19)17-10-11-17)16-9-4-12-20-14-16/h1-9,12,14,17H,10-11,13H2/b8-5+