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tert-butyl 2-(6-azanyl-5-oxidanylidene-3-phenyl-1,4-thiazepan-4-yl)ethanoate

tert-butyl 2-(6-azanyl-5-oxidanylidene-3-phenyl-1,4-thiazepan-4-yl)ethanoate

Systemtic Name:tert-butyl 2-(6-azanyl-5-oxidanylidene-3-phenyl-1,4-thiazepan-4-yl)ethanoate
Openeye Name:tert-butyl 2-(6-amino-5-oxo-3-phenyl-1,4-thiazepan-4-yl)acetate
CAS Name:2-(6-amino-5-oxo-3-phenyl-1,4-thiazepan-4-yl)acetic acid tert-butyl ester
IUPAC Name:tert-butyl 2-(6-amino-5-oxo-3-phenyl-1,4-thiazepan-4-yl)acetate
Traditional Name:2-(6-amino-5-keto-3-phenyl-1,4-thiazepan-4-yl)acetic acid tert-butyl ester
Formula: C17H24N2O3S
MolecularWeight: 336.44906
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CN1C(CSCC(C1=O)N)C2=CC=CC=C2


Isomeric SMILES

CC(C)(C)OC(=O)CN1C(CSCC(C1=O)N)C2=CC=CC=C2


InChI

InChI=1S/C17H24N2O3S/c1-17(2,3)22-15(20)9-19-14(12-7-5-4-6-8-12)11-23-10-13(18)16(19)21/h4-8,13-14H,9-11,18H2,1-3H3


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