6-methoxycarbonyl-7-(7-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)-4,7-dihydro-1,4-thiazepine-3-carboxylic acid

Systemtic Name: 6-methoxycarbonyl-7-(7-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)-4,7-dihydro-1,4-thiazepine-3-carboxylic acid Openeye Name: 6-methoxycarbonyl-7-(7-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)-4,7-dihydro-1,4-thiazepine-3-carboxylic acid CAS Name: 6-methoxycarbonyl-7-(7-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)-4,7-dihydro-1,4-thiazepine-3-carboxylic acid IUPAC Name: 6-methoxycarbonyl-7-(7-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)-4,7-dihydro-1,4-thiazepine-3-carboxylic acid Traditional Name: 6-carbomethoxy-7-(7-methyl-6,8-dihydro-5H-imidazo[1,2-a]pyrazin-2-yl)-4,7-dihydro-1,4-thiazepine-3-carboxylic acid Formula: C15H18N4O4S MolecularWeight: 350.39282

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN2C=C(N=C2C1)C3C(=CNC(=CS3)C(=O)O)C(=O)OC

Isomeric SMILES

CN1CCN2C=C(N=C2C1)C3C(=CNC(=CS3)C(=O)O)C(=O)OC

InChI

InChI=1S/C15H18N4O4S/c1-18-3-4-19-6-10(17-12(19)7-18)13-9(15(22)23-2)5-16-11(8-24-13)14(20)21/h5-6,8,13,16H,3-4,7H2,1-2H3,(H,20,21)