3-azanyl-4-(9-bromanyl-2,3-dimethyl-benzo[f][1]benzothiol-4-yl)phenol

Systemtic Name: 3-azanyl-4-(9-bromanyl-2,3-dimethyl-benzo[f][1]benzothiol-4-yl)phenol Openeye Name: 3-amino-4-(9-bromo-2,3-dimethyl-benzo[f]benzothiophen-4-yl)phenol CAS Name: 3-amino-4-(9-bromo-2,3-dimethyl-4-benzo[f][1]benzothiolyl)phenol IUPAC Name: 3-amino-4-(9-bromo-2,3-dimethylbenzo[f][1]benzothiol-4-yl)phenol Traditional Name: 3-amino-4-(9-bromo-2,3-dimethyl-benzo[f]benzothiophen-4-yl)phenol Formula: C20H16BrNOS MolecularWeight: 398.31614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C(C3=CC=CC=C3C(=C12)C4=C(C=C(C=C4)O)N)Br)C

Isomeric SMILES

CC1=C(SC2=C(C3=CC=CC=C3C(=C12)C4=C(C=C(C=C4)O)N)Br)C

InChI

InChI=1S/C20H16BrNOS/c1-10-11(2)24-20-17(10)18(15-8-7-12(23)9-16(15)22)13-5-3-4-6-14(13)19(20)21/h3-9,23H,22H2,1-2H3