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

Systemtic Name: 5-[3-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[3-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[3-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[3-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[3-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(4-methoxyphenyl)-1,3,4-thiadiazole-2-carboxamide Formula: C23H29N5O4S MolecularWeight: 471.57246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)C(=O)N3CCCC(C3)C(=O)N4CCCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)C(=O)N3CCCC(C3)C(=O)N4CCCCCC4

InChI

InChI=1S/C23H29N5O4S/c1-32-18-10-8-17(9-11-18)24-19(29)20-25-26-21(33-20)23(31)28-14-6-7-16(15-28)22(30)27-12-4-2-3-5-13-27/h8-11,16H,2-7,12-15H2,1H3,(H,24,29)