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

Systemtic Name: 2-(2-phenyl-4,5-dihydro-1,5-benzothiazepin-4-yl)phenol Openeye Name: 2-(2-phenyl-4,5-dihydro-1,5-benzothiazepin-4-yl)phenol CAS Name: 2-(2-phenyl-4,5-dihydro-1,5-benzothiazepin-4-yl)phenol IUPAC Name: 2-(2-phenyl-4,5-dihydro-1,5-benzothiazepin-4-yl)phenol Traditional Name: 2-(2-phenyl-4,5-dihydro-1,5-benzothiazepin-4-yl)phenol Formula: C21H17NOS MolecularWeight: 331.43078

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(NC3=CC=CC=C3S2)C4=CC=CC=C4O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(NC3=CC=CC=C3S2)C4=CC=CC=C4O

InChI

InChI=1S/C21H17NOS/c23-19-12-6-4-10-16(19)18-14-21(15-8-2-1-3-9-15)24-20-13-7-5-11-17(20)22-18/h1-14,18,22-23H