tert-butyl N-[(3S)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]carbamate

Systemtic Name: tert-butyl N-[(3S)-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]carbamate Openeye Name: tert-butyl N-[(3S)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]carbamate CAS Name: N-[(3S)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(3S)-4-oxo-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]carbamate Traditional Name: N-[(3S)-4-keto-3,5-dihydro-2H-1,5-benzothiazepin-3-yl]carbamic acid tert-butyl ester Formula: C14H18N2O3S MolecularWeight: 294.36932

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NC1CSC2=CC=CC=C2NC1=O

Isomeric SMILES

CC(C)(C)OC(=O)N[C@@H]1CSC2=CC=CC=C2NC1=O

InChI

InChI=1S/C14H18N2O3S/c1-14(2,3)19-13(18)16-10-8-20-11-7-5-4-6-9(11)15-12(10)17/h4-7,10H,8H2,1-3H3,(H,15,17)(H,16,18)/t10-/m1/s1