3-[2-[4-[[4,6-bis(bromanyl)-1,3-benzothiazol-2-yl]diazenyl]phenyl]ethylamino]propanenitrile

Systemtic Name: 3-[2-[4-[[4,6-bis(bromanyl)-1,3-benzothiazol-2-yl]diazenyl]phenyl]ethylamino]propanenitrile Openeye Name: 3-[2-[4-[(4,6-dibromo-1,3-benzothiazol-2-yl)azo]phenyl]ethylamino]propanenitrile CAS Name: 3-[2-[4-[(4,6-dibromo-1,3-benzothiazol-2-yl)azo]phenyl]ethylamino]propanenitrile IUPAC Name: 3-[2-[4-[(4,6-dibromo-1,3-benzothiazol-2-yl)diazenyl]phenyl]ethylamino]propanenitrile Traditional Name: 3-[2-[4-[(4,6-dibromo-1,3-benzothiazol-2-yl)azo]phenyl]ethylamino]propionitrile Formula: C18H15Br2N5S MolecularWeight: 493.2182

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNCCC#N)N=NC2=NC3=C(C=C(C=C3S2)Br)Br

Isomeric SMILES

C1=CC(=CC=C1CCNCCC#N)N=NC2=NC3=C(C=C(C=C3S2)Br)Br

InChI

InChI=1S/C18H15Br2N5S/c19-13-10-15(20)17-16(11-13)26-18(23-17)25-24-14-4-2-12(3-5-14)6-9-22-8-1-7-21/h2-5,10-11,22H,1,6,8-9H2