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

Systemtic Name: 5-[4-(azepan-1-ylcarbonyl)piperidin-1-yl]carbonyl-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide Openeye Name: 5-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(p-tolyl)-1,3,4-thiadiazole-2-carboxamide CAS Name: 5-[[4-[1-azepanyl(oxo)methyl]-1-piperidinyl]-oxomethyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide IUPAC Name: 5-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(4-methylphenyl)-1,3,4-thiadiazole-2-carboxamide Traditional Name: 5-[4-(azepane-1-carbonyl)piperidine-1-carbonyl]-N-(p-tolyl)-1,3,4-thiadiazole-2-carboxamide Formula: C23H29N5O3S MolecularWeight: 455.57306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=NN=C(S2)C(=O)N3CCC(CC3)C(=O)N4CCCCCC4

InChI

InChI=1S/C23H29N5O3S/c1-16-6-8-18(9-7-16)24-19(29)20-25-26-21(32-20)23(31)28-14-10-17(11-15-28)22(30)27-12-4-2-3-5-13-27/h6-9,17H,2-5,10-15H2,1H3,(H,24,29)