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ethyl (3S)-5-azanyl-2,3,6,7-tetrahydro-1,4-thiazepine-3-carboxylate

ethyl (3S)-5-azanyl-2,3,6,7-tetrahydro-1,4-thiazepine-3-carboxylate

Systemtic Name:ethyl (3S)-5-azanyl-2,3,6,7-tetrahydro-1,4-thiazepine-3-carboxylate
Openeye Name:ethyl (3S)-5-amino-2,3,6,7-tetrahydro-1,4-thiazepine-3-carboxylate
CAS Name:(3S)-5-amino-2,3,6,7-tetrahydro-1,4-thiazepine-3-carboxylic acid ethyl ester
IUPAC Name:ethyl (3S)-5-amino-2,3,6,7-tetrahydro-1,4-thiazepine-3-carboxylate
Traditional Name:(3S)-5-amino-2,3,6,7-tetrahydro-1,4-thiazepine-3-carboxylic acid ethyl ester
Formula: C8H14N2O2S
MolecularWeight: 202.27396
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CSCCC(=N1)N


Isomeric SMILES

CCOC(=O)[C@H]1CSCCC(=N1)N


InChI

InChI=1S/C8H14N2O2S/c1-2-12-8(11)6-5-13-4-3-7(9)10-6/h6H,2-5H2,1H3,(H2,9,10)/t6-/m1/s1


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