ethyl 2-[(2R,3S)-3-azanyl-4-oxidanylidene-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl]ethanoate

Systemtic Name: ethyl 2-[(2R,3S)-3-azanyl-4-oxidanylidene-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl]ethanoate Openeye Name: ethyl 2-[(2R,3S)-3-amino-4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl]acetate CAS Name: 2-[(2R,3S)-3-amino-4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2R,3S)-3-amino-4-oxo-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl]acetate Traditional Name: 2-[(2R,3S)-3-amino-4-keto-2-phenyl-2,3-dihydro-1,5-benzothiazepin-5-yl]acetic acid ethyl ester Formula: C19H20N2O3S MolecularWeight: 356.4387

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=CC=CC=C2SC(C(C1=O)N)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)CN1C2=CC=CC=C2S[C@@H]([C@H](C1=O)N)C3=CC=CC=C3

InChI

InChI=1S/C19H20N2O3S/c1-2-24-16(22)12-21-14-10-6-7-11-15(14)25-18(17(20)19(21)23)13-8-4-3-5-9-13/h3-11,17-18H,2,12,20H2,1H3/t17-,18-/m1/s1