1-[(2R,3S)-7-methoxy-2,3-dimethyl-3,5-dihydro-2H-1,4-benzothiazepin-4-yl]prop-2-en-1-one

Systemtic Name: 1-[(2R,3S)-7-methoxy-2,3-dimethyl-3,5-dihydro-2H-1,4-benzothiazepin-4-yl]prop-2-en-1-one Openeye Name: 1-[(2R,3S)-7-methoxy-2,3-dimethyl-3,5-dihydro-2H-1,4-benzothiazepin-4-yl]prop-2-en-1-one CAS Name: 1-[(2R,3S)-7-methoxy-2,3-dimethyl-3,5-dihydro-2H-1,4-benzothiazepin-4-yl]-2-propen-1-one IUPAC Name: 1-[(2R,3S)-7-methoxy-2,3-dimethyl-3,5-dihydro-2H-1,4-benzothiazepin-4-yl]prop-2-en-1-one Traditional Name: 1-[(2R,3S)-7-methoxy-2,3-dimethyl-3,5-dihydro-2H-1,4-benzothiazepin-4-yl]prop-2-en-1-one Formula: C15H19NO2S MolecularWeight: 277.38186

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(SC2=C(CN1C(=O)C=C)C=C(C=C2)OC)C

Isomeric SMILES

C[C@H]1[C@H](SC2=C(CN1C(=O)C=C)C=C(C=C2)OC)C

InChI

InChI=1S/C15H19NO2S/c1-5-15(17)16-9-12-8-13(18-4)6-7-14(12)19-11(3)10(16)2/h5-8,10-11H,1,9H2,2-4H3/t10-,11+/m0/s1