1-[(E)-2-methylsulfanyl-1-(2-pentoxyphenyl)ethenyl]imidazole; O-naphthalen-2-yl N-methyl-N-(3-methylphenyl)carbamothioate

Systemtic Name: 1-[(E)-2-methylsulfanyl-1-(2-pentoxyphenyl)ethenyl]imidazole; O-naphthalen-2-yl N-methyl-N-(3-methylphenyl)carbamothioate Openeye Name: 1-[(E)-2-methylsulfanyl-1-(2-pentoxyphenyl)vinyl]imidazole; O-(2-naphthyl) N-methyl-N-(m-tolyl)carbamothioate CAS Name: N-methyl-N-(3-methylphenyl)carbamothioic acid O-(2-naphthalenyl) ester; 1-[(E)-2-(methylthio)-1-(2-pentoxyphenyl)ethenyl]imidazole IUPAC Name: 1-[(E)-2-methylsulfanyl-1-(2-pentoxyphenyl)ethenyl]imidazole; O-naphthalen-2-yl N-methyl-N-(3-methylphenyl)carbamothioate Traditional Name: 1-[(E)-1-(2-amoxyphenyl)-2-(methylthio)vinyl]imidazole; N-methyl-N-(m-tolyl)thiocarbamic acid O-(2-naphthyl) ester Formula: C36H39N3O2S2 MolecularWeight: 609.84376

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=CSC)N2C=CN=C2.CC1=CC(=CC=C1)N(C)C(=S)OC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCCOC1=CC=CC=C1/C(=C\SC)/N2C=CN=C2.CC1=CC(=CC=C1)N(C)C(=S)OC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C19H17NOS.C17H22N2OS/c1-14-6-5-9-17(12-14)20(2)19(22)21-18-11-10-15-7-3-4-8-16(15)13-18;1-3-4-7-12-20-17-9-6-5-8-15(17)16(13-21-2)19-11-10-18-14-19/h3-13H,1-2H3;5-6,8-11,13-14H,3-4,7,12H2,1-2H3/b;16-13+