5-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-3,4-dihydro-2H-1,5-benzothiazepine

Systemtic Name: 5-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-3,4-dihydro-2H-1,5-benzothiazepine Openeye Name: 5-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-3,4-dihydro-2H-1,5-benzothiazepine CAS Name: 5-[(1,3,5-trimethyl-4-pyrazolyl)sulfonyl]-3,4-dihydro-2H-1,5-benzothiazepine IUPAC Name: 5-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-3,4-dihydro-2H-1,5-benzothiazepine Traditional Name: 5-(1,3,5-trimethylpyrazol-4-yl)sulfonyl-3,4-dihydro-2H-1,5-benzothiazepine Formula: C15H19N3O2S2 MolecularWeight: 337.46026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)S(=O)(=O)N2CCCSC3=CC=CC=C32

Isomeric SMILES

CC1=C(C(=NN1C)C)S(=O)(=O)N2CCCSC3=CC=CC=C32

InChI

InChI=1S/C15H19N3O2S2/c1-11-15(12(2)17(3)16-11)22(19,20)18-9-6-10-21-14-8-5-4-7-13(14)18/h4-5,7-8H,6,9-10H2,1-3H3