N-[5-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]butanamide

Systemtic Name: N-[5-[2-oxidanylidene-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]butanamide Openeye Name: N-[5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]butanamide CAS Name: N-[5-[[2-oxo-2-(4-phenyl-1-piperazinyl)ethyl]thio]-1,3,4-thiadiazol-2-yl]butanamide IUPAC Name: N-[5-[2-oxo-2-(4-phenylpiperazin-1-yl)ethyl]sulfanyl-1,3,4-thiadiazol-2-yl]butanamide Traditional Name: N-[5-[[2-keto-2-(4-phenylpiperazino)ethyl]thio]-1,3,4-thiadiazol-2-yl]butyramide Formula: C18H23N5O2S2 MolecularWeight: 405.53752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=NN=C(S1)SCC(=O)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCCC(=O)NC1=NN=C(S1)SCC(=O)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C18H23N5O2S2/c1-2-6-15(24)19-17-20-21-18(27-17)26-13-16(25)23-11-9-22(10-12-23)14-7-4-3-5-8-14/h3-5,7-8H,2,6,9-13H2,1H3,(H,19,20,24)