2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)ethanamide

Systemtic Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)ethanamide Openeye Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)acetamide CAS Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)acetamide IUPAC Name: 2-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)acetamide Traditional Name: N-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-2-(4-piperonylpiperazino)acetamide Formula: C22H29N5O3S MolecularWeight: 443.56236

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=NN=C(S2)NC(=O)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCC(CC1)C2=NN=C(S2)NC(=O)CN3CCN(CC3)CC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H29N5O3S/c28-20(23-22-25-24-21(31-22)17-4-2-1-3-5-17)14-27-10-8-26(9-11-27)13-16-6-7-18-19(12-16)30-15-29-18/h6-7,12,17H,1-5,8-11,13-15H2,(H,23,25,28)