N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-4-ethyl-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-4-ethyl-1,2,3-thiadiazole-5-carboxamide Openeye Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-4-ethyl-thiadiazole-5-carboxamide CAS Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-4-ethyl-5-thiadiazolecarboxamide IUPAC Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-4-ethylthiadiazole-5-carboxamide Traditional Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-4-ethyl-thiadiazole-5-carboxamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SN=N1)C(=O)NC(C)C2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCC1=C(SN=N1)C(=O)NC(C)C2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C16H19N3O3S/c1-3-12-15(23-19-18-12)16(20)17-10(2)11-5-6-13-14(9-11)22-8-4-7-21-13/h5-6,9-10H,3-4,7-8H2,1-2H3,(H,17,20)