[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-(2,4,5-trimethoxyphenyl)methanone

Systemtic Name: [(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-(2,4,5-trimethoxyphenyl)methanone Openeye Name: [(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-(2,4,5-trimethoxyphenyl)methanone CAS Name: [(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-(2,4,5-trimethoxyphenyl)methanone IUPAC Name: [(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]-(2,4,5-trimethoxyphenyl)methanone Traditional Name: asaryl-[(2S)-2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl]methanone Formula: C20H23NO4S MolecularWeight: 373.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)C3=CC(=C(C=C3OC)OC)OC

Isomeric SMILES

C[C@H]1CCN(C2=CC=CC=C2S1)C(=O)C3=CC(=C(C=C3OC)OC)OC

InChI

InChI=1S/C20H23NO4S/c1-13-9-10-21(15-7-5-6-8-19(15)26-13)20(22)14-11-17(24-3)18(25-4)12-16(14)23-2/h5-8,11-13H,9-10H2,1-4H3/t13-/m0/s1