3-bromanyl-4-(2-diethylaminoethyloxy)-5-methoxy-benzenecarbothioamide

Systemtic Name: 3-bromanyl-4-(2-diethylaminoethyloxy)-5-methoxy-benzenecarbothioamide Openeye Name: 3-bromo-4-(2-diethylaminoethyloxy)-5-methoxy-benzenecarbothioamide CAS Name: 3-bromo-4-(2-diethylaminoethyloxy)-5-methoxybenzenecarbothioamide IUPAC Name: 3-bromo-4-(2-diethylaminoethyloxy)-5-methoxybenzenecarbothioamide Traditional Name: 3-bromo-4-(2-diethylaminoethyloxy)-5-methoxy-thiobenzamide Formula: C14H21BrN2O2S MolecularWeight: 361.29774

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=C(C=C(C=C1Br)C(=S)N)OC

Isomeric SMILES

CCN(CC)CCOC1=C(C=C(C=C1Br)C(=S)N)OC

InChI

InChI=1S/C14H21BrN2O2S/c1-4-17(5-2)6-7-19-13-11(15)8-10(14(16)20)9-12(13)18-3/h8-9H,4-7H2,1-3H3,(H2,16,20)