4-(4-bromophenyl)-6-cyclopropyl-2-prop-2-enylsulfanyl-pyridine-3-carbonitrile

Systemtic Name: 4-(4-bromophenyl)-6-cyclopropyl-2-prop-2-enylsulfanyl-pyridine-3-carbonitrile Openeye Name: 2-allylsulfanyl-4-(4-bromophenyl)-6-cyclopropyl-pyridine-3-carbonitrile CAS Name: 4-(4-bromophenyl)-6-cyclopropyl-2-(prop-2-enylthio)-3-pyridinecarbonitrile IUPAC Name: 4-(4-bromophenyl)-6-cyclopropyl-2-prop-2-enylsulfanylpyridine-3-carbonitrile Traditional Name: 2-(allylthio)-4-(4-bromophenyl)-6-cyclopropyl-nicotinonitrile Formula: C18H15BrN2S MolecularWeight: 371.2941

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Descriptors Computed from Structure

Canonical SMILES:

C=CCSC1=C(C(=CC(=N1)C2CC2)C3=CC=C(C=C3)Br)C#N

Isomeric SMILES

C=CCSC1=C(C(=CC(=N1)C2CC2)C3=CC=C(C=C3)Br)C#N

InChI

InChI=1S/C18H15BrN2S/c1-2-9-22-18-16(11-20)15(10-17(21-18)13-3-4-13)12-5-7-14(19)8-6-12/h2,5-8,10,13H,1,3-4,9H2