4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-oxidanylidene-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide

Systemtic Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-oxidanylidene-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide Openeye Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide CAS Name: 4-[4-(2,3-dimethylphenyl)-1-piperazinyl]-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide IUPAC Name: 4-[4-(2,3-dimethylphenyl)piperazin-1-yl]-4-oxo-N-(5-propyl-1,3,4-thiadiazol-2-yl)butanamide Traditional Name: 4-[4-(2,3-dimethylphenyl)piperazino]-4-keto-N-(5-propyl-1,3,4-thiadiazol-2-yl)butyramide Formula: C21H29N5O2S MolecularWeight: 415.55226

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)C3=CC=CC(=C3C)C

Isomeric SMILES

CCCC1=NN=C(S1)NC(=O)CCC(=O)N2CCN(CC2)C3=CC=CC(=C3C)C

InChI

InChI=1S/C21H29N5O2S/c1-4-6-19-23-24-21(29-19)22-18(27)9-10-20(28)26-13-11-25(12-14-26)17-8-5-7-15(2)16(17)3/h5,7-8H,4,6,9-14H2,1-3H3,(H,22,24,27)