4-(3-phenylprop-2-ynyl)-3,5-dihydro-2H-1,4-benzothiazepine

Systemtic Name: 4-(3-phenylprop-2-ynyl)-3,5-dihydro-2H-1,4-benzothiazepine Openeye Name: 4-(3-phenylprop-2-ynyl)-3,5-dihydro-2H-1,4-benzothiazepine CAS Name: 4-(3-phenylprop-2-ynyl)-3,5-dihydro-2H-1,4-benzothiazepine IUPAC Name: 4-(3-phenylprop-2-ynyl)-3,5-dihydro-2H-1,4-benzothiazepine Traditional Name: 4-(3-phenylprop-2-ynyl)-3,5-dihydro-2H-1,4-benzothiazepine Formula: C18H17NS MolecularWeight: 279.39928

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Descriptors Computed from Structure

Canonical SMILES:

C1CSC2=CC=CC=C2CN1CC#CC3=CC=CC=C3

Isomeric SMILES

C1CSC2=CC=CC=C2CN1CC#CC3=CC=CC=C3

InChI

InChI=1S/C18H17NS/c1-2-7-16(8-3-1)9-6-12-19-13-14-20-18-11-5-4-10-17(18)15-19/h1-5,7-8,10-11H,12-15H2