2-(2-isothiocyanatophenyl)-5-oct-7-enyl-pyrimidine

Systemtic Name: 2-(2-isothiocyanatophenyl)-5-oct-7-enyl-pyrimidine Openeye Name: 2-(2-isothiocyanatophenyl)-5-oct-7-enyl-pyrimidine CAS Name: 2-(2-isothiocyanatophenyl)-5-oct-7-enylpyrimidine IUPAC Name: 2-(2-isothiocyanatophenyl)-5-oct-7-enylpyrimidine Traditional Name: 2-(2-isothiocyanatophenyl)-5-oct-7-enyl-pyrimidine Formula: C19H21N3S MolecularWeight: 323.45514

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Descriptors Computed from Structure

Canonical SMILES:

C=CCCCCCCC1=CN=C(N=C1)C2=CC=CC=C2N=C=S

Isomeric SMILES

C=CCCCCCCC1=CN=C(N=C1)C2=CC=CC=C2N=C=S

InChI

InChI=1S/C19H21N3S/c1-2-3-4-5-6-7-10-16-13-20-19(21-14-16)17-11-8-9-12-18(17)22-15-23/h2,8-9,11-14H,1,3-7,10H2