(2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-[4-(pyrazol-1-ylmethyl)phenyl]methanone

Systemtic Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-[4-(pyrazol-1-ylmethyl)phenyl]methanone Openeye Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-[4-(pyrazol-1-ylmethyl)phenyl]methanone CAS Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-[4-(1-pyrazolylmethyl)phenyl]methanone IUPAC Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-[4-(pyrazol-1-ylmethyl)phenyl]methanone Traditional Name: (2-methyl-3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-[4-(pyrazol-1-ylmethyl)phenyl]methanone Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(C2=CC=CC=C2S1)C(=O)C3=CC=C(C=C3)CN4C=CC=N4

Isomeric SMILES

CC1CCN(C2=CC=CC=C2S1)C(=O)C3=CC=C(C=C3)CN4C=CC=N4

InChI

InChI=1S/C21H21N3OS/c1-16-11-14-24(19-5-2-3-6-20(19)26-16)21(25)18-9-7-17(8-10-18)15-23-13-4-12-22-23/h2-10,12-13,16H,11,14-15H2,1H3