3-(2-pyridin-3-yl-2,3-dihydro-1,5-benzothiazepin-4-yl)phenol

Systemtic Name: 3-(2-pyridin-3-yl-2,3-dihydro-1,5-benzothiazepin-4-yl)phenol Openeye Name: 3-[2-(3-pyridyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]phenol CAS Name: 3-[2-(3-pyridinyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]phenol IUPAC Name: 3-(2-pyridin-3-yl-2,3-dihydro-1,5-benzothiazepin-4-yl)phenol Traditional Name: 3-[2-(3-pyridyl)-2,3-dihydro-1,5-benzothiazepin-4-yl]phenol Formula: C20H16N2OS MolecularWeight: 332.41884

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C2N=C1C3=CC(=CC=C3)O)C4=CN=CC=C4

Isomeric SMILES

C1C(SC2=CC=CC=C2N=C1C3=CC(=CC=C3)O)C4=CN=CC=C4

InChI

InChI=1S/C20H16N2OS/c23-16-7-3-5-14(11-16)18-12-20(15-6-4-10-21-13-15)24-19-9-2-1-8-17(19)22-18/h1-11,13,20,23H,12H2