2-(4-isothiocyanatophenyl)-5-[(E)-pent-3-enyl]pyridine

Systemtic Name: 2-(4-isothiocyanatophenyl)-5-[(E)-pent-3-enyl]pyridine Openeye Name: 2-(4-isothiocyanatophenyl)-5-[(E)-pent-3-enyl]pyridine CAS Name: 2-(4-isothiocyanatophenyl)-5-[(E)-pent-3-enyl]pyridine IUPAC Name: 2-(4-isothiocyanatophenyl)-5-[(E)-pent-3-enyl]pyridine Traditional Name: 2-(4-isothiocyanatophenyl)-5-[(E)-pent-3-enyl]pyridine Formula: C17H16N2S MolecularWeight: 280.38734

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Descriptors Computed from Structure

Canonical SMILES:

CC=CCCC1=CN=C(C=C1)C2=CC=C(C=C2)N=C=S

Isomeric SMILES

C/C=C/CCC1=CN=C(C=C1)C2=CC=C(C=C2)N=C=S

InChI

InChI=1S/C17H16N2S/c1-2-3-4-5-14-6-11-17(18-12-14)15-7-9-16(10-8-15)19-13-20/h2-3,6-12H,4-5H2,1H3/b3-2+