tert-butyl 2-(4-azanyl-1,2-benzothiazepin-3-yl)ethanoate

Systemtic Name: tert-butyl 2-(4-azanyl-1,2-benzothiazepin-3-yl)ethanoate Openeye Name: tert-butyl 2-(4-amino-1,2-benzothiazepin-3-yl)acetate CAS Name: 2-(4-amino-1,2-benzothiazepin-3-yl)acetic acid tert-butyl ester IUPAC Name: tert-butyl 2-(4-amino-1,2-benzothiazepin-3-yl)acetate Traditional Name: 2-(4-amino-1,2-benzothiazepin-3-yl)acetic acid tert-butyl ester Formula: C15H18N2O2S MolecularWeight: 290.38062

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)CC1=NSC2=CC=CC=C2C=C1N

Isomeric SMILES

CC(C)(C)OC(=O)CC1=NSC2=CC=CC=C2C=C1N

InChI

InChI=1S/C15H18N2O2S/c1-15(2,3)19-14(18)9-12-11(16)8-10-6-4-5-7-13(10)20-17-12/h4-8H,9,16H2,1-3H3