11-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]naphtho[2,3-b][1]benzothiole-6-carbonitrile

Systemtic Name: 11-[3,5-bis(bromanyl)-4-oxidanyl-phenyl]naphtho[2,3-b][1]benzothiole-6-carbonitrile Openeye Name: 11-(3,5-dibromo-4-hydroxy-phenyl)naphtho[2,3-b]benzothiophene-6-carbonitrile CAS Name: 11-(3,5-dibromo-4-hydroxyphenyl)-6-naphtho[2,3-b][1]benzothiolecarbonitrile IUPAC Name: 11-(3,5-dibromo-4-hydroxyphenyl)naphtho[2,3-b][1]benzothiole-6-carbonitrile Traditional Name: 11-(3,5-dibromo-4-hydroxy-phenyl)naphtho[2,3-b]benzothiophene-6-carbonitrile Formula: C23H11Br2NOS MolecularWeight: 509.21254

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=C3C(=C2C4=CC(=C(C(=C4)Br)O)Br)C5=CC=CC=C5S3)C#N

Isomeric SMILES

C1=CC=C2C(=C1)C(=C3C(=C2C4=CC(=C(C(=C4)Br)O)Br)C5=CC=CC=C5S3)C#N

InChI

InChI=1S/C23H11Br2NOS/c24-17-9-12(10-18(25)22(17)27)20-14-6-2-1-5-13(14)16(11-26)23-21(20)15-7-3-4-8-19(15)28-23/h1-10,27H