6-bromanyl-3-(4-heptylphenyl)-1,3-benzoxazine-2,4-dithione

Systemtic Name: 6-bromanyl-3-(4-heptylphenyl)-1,3-benzoxazine-2,4-dithione Openeye Name: 6-bromo-3-(4-heptylphenyl)-1,3-benzoxazine-2,4-dithione CAS Name: 6-bromo-3-(4-heptylphenyl)-1,3-benzoxazine-2,4-dithione IUPAC Name: 6-bromo-3-(4-heptylphenyl)-1,3-benzoxazine-2,4-dithione Traditional Name: 6-bromo-3-(4-heptylphenyl)-1,3-benzoxazine-2,4-dithione Formula: C21H22BrNOS2 MolecularWeight: 448.43948

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC1=CC=C(C=C1)N2C(=S)C3=C(C=CC(=C3)Br)OC2=S

Isomeric SMILES

CCCCCCCC1=CC=C(C=C1)N2C(=S)C3=C(C=CC(=C3)Br)OC2=S

InChI

InChI=1S/C21H22BrNOS2/c1-2-3-4-5-6-7-15-8-11-17(12-9-15)23-20(25)18-14-16(22)10-13-19(18)24-21(23)26/h8-14H,2-7H2,1H3