[(5Z)-5-(phenylsulfanylmethylidene)-4,4-dipropyl-1,3-thiazol-2-yl]sulfanylmethyl thiocyanate

Systemtic Name: [(5Z)-5-(phenylsulfanylmethylidene)-4,4-dipropyl-1,3-thiazol-2-yl]sulfanylmethyl thiocyanate Openeye Name: [(5Z)-5-(phenylsulfanylmethylene)-4,4-dipropyl-thiazol-2-yl]sulfanylmethyl thiocyanate CAS Name: thiocyanic acid [[(5Z)-5-[(phenylthio)methylidene]-4,4-dipropyl-2-thiazolyl]thio]methyl ester IUPAC Name: [(5Z)-5-(phenylsulfanylmethylidene)-4,4-dipropyl-1,3-thiazol-2-yl]sulfanylmethyl thiocyanate Traditional Name: thiocyanic acid [[(5Z)-5-[(phenylthio)methylene]-4,4-dipropyl-2-thiazolin-2-yl]thio]methyl ester Formula: C18H22N2S4 MolecularWeight: 394.64068

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(C(=CSC2=CC=CC=C2)SC(=N1)SCSC#N)CCC

Isomeric SMILES

CCCC1(/C(=C/SC2=CC=CC=C2)/SC(=N1)SCSC#N)CCC

InChI

InChI=1S/C18H22N2S4/c1-3-10-18(11-4-2)16(12-22-15-8-6-5-7-9-15)24-17(20-18)23-14-21-13-19/h5-9,12H,3-4,10-11,14H2,1-2H3/b16-12-