6-[(2S)-2-(4-hydroxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[(2S)-2-(4-hydroxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[(2S)-2-(4-hydroxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[(2S)-2-(4-hydroxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[(2S)-2-(4-hydroxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[(2S)-2-(4-hydroxyphenyl)-3,5-dihydro-2H-1,5-benzothiazepin-4-ylidene]cyclohexa-2,4-dien-1-one Formula: C21H17NO2S MolecularWeight: 347.43018

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Descriptors Computed from Structure

Canonical SMILES:

C1C(SC2=CC=CC=C2NC1=C3C=CC=CC3=O)C4=CC=C(C=C4)O

Isomeric SMILES

C1[C@H](SC2=CC=CC=C2NC1=C3C=CC=CC3=O)C4=CC=C(C=C4)O

InChI

InChI=1S/C21H17NO2S/c23-15-11-9-14(10-12-15)21-13-18(16-5-1-3-7-19(16)24)22-17-6-2-4-8-20(17)25-21/h1-12,21-23H,13H2/t21-/m0/s1