5-[3-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-N-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazole-2-carboxamide

Systemtic Name: 5-[3-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-N-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[3-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[3-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]-N-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[3-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[3-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(1,3-benzodioxol-5-yl)-1,3,4-thiadiazole-2-carboxamide Formula: C23H27N5O5S MolecularWeight: 485.55598

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2CCCN(C2)C(=O)C3=NN=C(S3)C(=O)NC4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCCN(CC1)C(=O)C2CCCN(C2)C(=O)C3=NN=C(S3)C(=O)NC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H27N5O5S/c29-19(24-16-7-8-17-18(12-16)33-14-32-17)20-25-26-21(34-20)23(31)28-11-5-6-15(13-28)22(30)27-9-3-1-2-4-10-27/h7-8,12,15H,1-6,9-11,13-14H2,(H,24,29)