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

Systemtic Name: 4-(2-phenyl-2,5-dihydro-1,5-benzothiazepin-4-yl)phenol Openeye Name: 4-(2-phenyl-2,5-dihydro-1,5-benzothiazepin-4-yl)phenol CAS Name: 4-(2-phenyl-2,5-dihydro-1,5-benzothiazepin-4-yl)phenol IUPAC Name: 4-(2-phenyl-2,5-dihydro-1,5-benzothiazepin-4-yl)phenol Traditional Name: 4-(2-phenyl-2,5-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)C2C=C(NC3=CC=CC=C3S2)C4=CC=C(C=C4)O

Isomeric SMILES

C1=CC=C(C=C1)C2C=C(NC3=CC=CC=C3S2)C4=CC=C(C=C4)O

InChI

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