4-(diethylaminomethyl)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

Systemtic Name: 4-(diethylaminomethyl)-N-[5-(phenylmethylsulfanyl)-1,3,4-thiadiazol-2-yl]benzamide Openeye Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(diethylaminomethyl)benzamide CAS Name: 4-(diethylaminomethyl)-N-[5-(phenylmethylthio)-1,3,4-thiadiazol-2-yl]benzamide IUPAC Name: N-(5-benzylsulfanyl-1,3,4-thiadiazol-2-yl)-4-(diethylaminomethyl)benzamide Traditional Name: N-[5-(benzylthio)-1,3,4-thiadiazol-2-yl]-4-(diethylaminomethyl)benzamide Formula: C21H24N4OS2 MolecularWeight: 412.57146

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3

Isomeric SMILES

CCN(CC)CC1=CC=C(C=C1)C(=O)NC2=NN=C(S2)SCC3=CC=CC=C3

InChI

InChI=1S/C21H24N4OS2/c1-3-25(4-2)14-16-10-12-18(13-11-16)19(26)22-20-23-24-21(28-20)27-15-17-8-6-5-7-9-17/h5-13H,3-4,14-15H2,1-2H3,(H,22,23,26)