N-[[3-[3-(dimethylamino)-3-oxidanylidene-propyl]phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide

Systemtic Name: N-[[3-[3-(dimethylamino)-3-oxidanylidene-propyl]phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide Openeye Name: N-[[3-[3-(dimethylamino)-3-oxo-propyl]phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide CAS Name: N-[[3-[3-(dimethylamino)-3-oxopropyl]anilino]-sulfanylidenemethyl]-4-(2-methoxyethoxy)benzamide IUPAC Name: N-[[3-[3-(dimethylamino)-3-oxopropyl]phenyl]carbamothioyl]-4-(2-methoxyethoxy)benzamide Traditional Name: N-[[3-[3-(dimethylamino)-3-keto-propyl]phenyl]thiocarbamoyl]-4-(2-methoxyethoxy)benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CCC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCOC

Isomeric SMILES

CN(C)C(=O)CCC1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCOC

InChI

InChI=1S/C22H27N3O4S/c1-25(2)20(26)12-7-16-5-4-6-18(15-16)23-22(30)24-21(27)17-8-10-19(11-9-17)29-14-13-28-3/h4-6,8-11,15H,7,12-14H2,1-3H3,(H2,23,24,27,30)