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

Systemtic Name: 4-[4-cyclopropyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine Openeye Name: 4-[5-[(E)-cinnamyl]sulfanyl-4-cyclopropyl-1,2,4-triazol-3-yl]pyridine CAS Name: 4-[4-cyclopropyl-5-[[(E)-3-phenylprop-2-enyl]thio]-1,2,4-triazol-3-yl]pyridine IUPAC Name: 4-[4-cyclopropyl-5-[(E)-3-phenylprop-2-enyl]sulfanyl-1,2,4-triazol-3-yl]pyridine Traditional Name: 4-[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=CC=NC=C4

Isomeric SMILES

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

InChI

InChI=1S/C19H18N4S/c1-2-5-15(6-3-1)7-4-14-24-19-22-21-18(23(19)17-8-9-17)16-10-12-20-13-11-16/h1-7,10-13,17H,8-9,14H2/b7-4+