N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide

Systemtic Name: N-(7-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-thiophen-2-ylcarbonyl-piperidine-3-carboxamide Openeye Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide CAS Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-[oxo(thiophen-2-yl)methyl]-3-piperidinecarboxamide IUPAC Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide Traditional Name: N-(7-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-1-(2-thenoyl)nipecotamide Formula: C20H21ClN2O4S MolecularWeight: 420.90974

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NC3=CC4=C(C=C3Cl)OCCCO4

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=CC=CS2)C(=O)NC3=CC4=C(C=C3Cl)OCCCO4

InChI

InChI=1S/C20H21ClN2O4S/c21-14-10-16-17(27-8-3-7-26-16)11-15(14)22-19(24)13-4-1-6-23(12-13)20(25)18-5-2-9-28-18/h2,5,9-11,13H,1,3-4,6-8,12H2,(H,22,24)