N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3,4,5-trimethoxy-benzamide

Systemtic Name: N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3,4,5-trimethoxy-benzamide Openeye Name: N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3,4,5-trimethoxy-benzamide CAS Name: N-[(1,2-dihydroacenaphthylen-5-ylamino)-sulfanylidenemethyl]-3,4,5-trimethoxybenzamide IUPAC Name: N-(1,2-dihydroacenaphthylen-5-ylcarbamothioyl)-3,4,5-trimethoxybenzamide Traditional Name: N-(acenaphthen-5-ylthiocarbamoyl)-3,4,5-trimethoxy-benzamide Formula: C23H22N2O4S MolecularWeight: 422.49678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=C3C=CC=C4C3=C(CC4)C=C2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)NC(=S)NC2=C3C=CC=C4C3=C(CC4)C=C2

InChI

InChI=1S/C23H22N2O4S/c1-27-18-11-15(12-19(28-2)21(18)29-3)22(26)25-23(30)24-17-10-9-14-8-7-13-5-4-6-16(17)20(13)14/h4-6,9-12H,7-8H2,1-3H3,(H2,24,25,26,30)