[3-ethyl-5-(4-phenylmethoxyphenyl)-4,5-dihydro-2H-1,4-benzothiazepin-3-yl]methanol

Systemtic Name: [3-ethyl-5-(4-phenylmethoxyphenyl)-4,5-dihydro-2H-1,4-benzothiazepin-3-yl]methanol Openeye Name: [5-(4-benzyloxyphenyl)-3-ethyl-4,5-dihydro-2H-1,4-benzothiazepin-3-yl]methanol CAS Name: [3-ethyl-5-(4-phenylmethoxyphenyl)-4,5-dihydro-2H-1,4-benzothiazepin-3-yl]methanol IUPAC Name: [3-ethyl-5-(4-phenylmethoxyphenyl)-4,5-dihydro-2H-1,4-benzothiazepin-3-yl]methanol Traditional Name: [5-(4-benzoxyphenyl)-3-ethyl-4,5-dihydro-2H-1,4-benzothiazepin-3-yl]methanol Formula: C25H27NO2S MolecularWeight: 405.55238

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Descriptors Computed from Structure

Canonical SMILES:

CCC1(CSC2=CC=CC=C2C(N1)C3=CC=C(C=C3)OCC4=CC=CC=C4)CO

Isomeric SMILES

CCC1(CSC2=CC=CC=C2C(N1)C3=CC=C(C=C3)OCC4=CC=CC=C4)CO

InChI

InChI=1S/C25H27NO2S/c1-2-25(17-27)18-29-23-11-7-6-10-22(23)24(26-25)20-12-14-21(15-13-20)28-16-19-8-4-3-5-9-19/h3-15,24,26-27H,2,16-18H2,1H3