methyl (6R)-6-azanyl-2-methyl-5-oxidanylidene-6,7-dihydro-4H-1,4-thiazepine-3-carboxylate

Systemtic Name: methyl (6R)-6-azanyl-2-methyl-5-oxidanylidene-6,7-dihydro-4H-1,4-thiazepine-3-carboxylate Openeye Name: methyl (6R)-6-amino-2-methyl-5-oxo-6,7-dihydro-4H-1,4-thiazepine-3-carboxylate CAS Name: (6R)-6-amino-2-methyl-5-oxo-6,7-dihydro-4H-1,4-thiazepine-3-carboxylic acid methyl ester IUPAC Name: methyl (6R)-6-amino-2-methyl-5-oxo-6,7-dihydro-4H-1,4-thiazepine-3-carboxylate Traditional Name: (6R)-6-amino-5-keto-2-methyl-6,7-dihydro-4H-1,4-thiazepine-3-carboxylic acid methyl ester Formula: C8H12N2O3S MolecularWeight: 216.25748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=O)C(CS1)N)C(=O)OC

Isomeric SMILES

CC1=C(NC(=O)[C@H](CS1)N)C(=O)OC

InChI

InChI=1S/C8H12N2O3S/c1-4-6(8(12)13-2)10-7(11)5(9)3-14-4/h5H,3,9H2,1-2H3,(H,10,11)/t5-/m0/s1