7-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-6-methoxycarbonyl-4,7-dihydro-1,4-thiazepine-3-carboxylic acid

Systemtic Name: 7-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-6-methoxycarbonyl-4,7-dihydro-1,4-thiazepine-3-carboxylic acid Openeye Name: 7-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-6-methoxycarbonyl-4,7-dihydro-1,4-thiazepine-3-carboxylic acid CAS Name: 7-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-6-methoxycarbonyl-4,7-dihydro-1,4-thiazepine-3-carboxylic acid IUPAC Name: 7-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-6-methoxycarbonyl-4,7-dihydro-1,4-thiazepine-3-carboxylic acid Traditional Name: 6-carbomethoxy-7-(6,7-dihydro-5H-pyrrol[1,2-a]imidazol-2-yl)-4,7-dihydro-1,4-thiazepine-3-carboxylic acid Formula: C14H15N3O4S MolecularWeight: 321.3516

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CNC(=CSC1C2=CN3CCCC3=N2)C(=O)O

Isomeric SMILES

COC(=O)C1=CNC(=CSC1C2=CN3CCCC3=N2)C(=O)O

InChI

InChI=1S/C14H15N3O4S/c1-21-14(20)8-5-15-10(13(18)19)7-22-12(8)9-6-17-4-2-3-11(17)16-9/h5-7,12,15H,2-4H2,1H3,(H,18,19)