2-[[5-[4-(2-phenylbutanoyl)piperazin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-propan-2-yl-ethanamide

Systemtic Name: 2-[[5-[4-(2-phenylbutanoyl)piperazin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-propan-2-yl-ethanamide Openeye Name: N-isopropyl-2-[[5-[4-(2-phenylbutanoyl)piperazin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetamide CAS Name: 2-[[5-[4-(1-oxo-2-phenylbutyl)-1-piperazinyl]-1,3,4-thiadiazol-2-yl]thio]-N-propan-2-ylacetamide IUPAC Name: 2-[[5-[4-(2-phenylbutanoyl)piperazin-1-yl]-1,3,4-thiadiazol-2-yl]sulfanyl]-N-propan-2-ylacetamide Traditional Name: N-isopropyl-2-[[5-[4-(2-phenylbutanoyl)piperazino]-1,3,4-thiadiazol-2-yl]thio]acetamide Formula: C21H29N5O2S2 MolecularWeight: 447.61726

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=NN=C(S3)SCC(=O)NC(C)C

Isomeric SMILES

CCC(C1=CC=CC=C1)C(=O)N2CCN(CC2)C3=NN=C(S3)SCC(=O)NC(C)C

InChI

InChI=1S/C21H29N5O2S2/c1-4-17(16-8-6-5-7-9-16)19(28)25-10-12-26(13-11-25)20-23-24-21(30-20)29-14-18(27)22-15(2)3/h5-9,15,17H,4,10-14H2,1-3H3,(H,22,27)