N-(3-methoxyphenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide

Systemtic Name: N-(3-methoxyphenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-ethanamide Openeye Name: N-(3-methoxyphenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanyl-acetamide CAS Name: 2-[[4-[[anilino(sulfanylidene)methyl]amino]phenyl]thio]-N-(3-methoxyphenyl)acetamide IUPAC Name: N-(3-methoxyphenyl)-2-[4-(phenylcarbamothioylamino)phenyl]sulfanylacetamide Traditional Name: N-(3-methoxyphenyl)-2-[[4-(phenylthiocarbamoylamino)phenyl]thio]acetamide Formula: C22H21N3O2S2 MolecularWeight: 423.55104

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)CSC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)CSC2=CC=C(C=C2)NC(=S)NC3=CC=CC=C3

InChI

InChI=1S/C22H21N3O2S2/c1-27-19-9-5-8-18(14-19)23-21(26)15-29-20-12-10-17(11-13-20)25-22(28)24-16-6-3-2-4-7-16/h2-14H,15H2,1H3,(H,23,26)(H2,24,25,28)