methyl 4-[[2-sulfanylidene-3-(1,2,3,4-tetrahydronaphthalen-2-yl)imidazol-1-yl]methyl]benzoate

Systemtic Name: methyl 4-[[2-sulfanylidene-3-(1,2,3,4-tetrahydronaphthalen-2-yl)imidazol-1-yl]methyl]benzoate Openeye Name: methyl 4-[(3-tetralin-2-yl-2-thioxo-imidazol-1-yl)methyl]benzoate CAS Name: 4-[[2-sulfanylidene-3-(1,2,3,4-tetrahydronaphthalen-2-yl)-1-imidazolyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[2-sulfanylidene-3-(1,2,3,4-tetrahydronaphthalen-2-yl)imidazol-1-yl]methyl]benzoate Traditional Name: 4-[(3-tetralin-2-yl-2-thioxo-4-imidazolin-1-yl)methyl]benzoic acid methyl ester Formula: C22H22N2O2S MolecularWeight: 378.48728

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CN2C=CN(C2=S)C3CCC4=CC=CC=C4C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CN2C=CN(C2=S)C3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H22N2O2S/c1-26-21(25)18-8-6-16(7-9-18)15-23-12-13-24(22(23)27)20-11-10-17-4-2-3-5-19(17)14-20/h2-9,12-13,20H,10-11,14-15H2,1H3