3-[4-(4-bromophenyl)-2-(2-nitrophenyl)imino-1,3-thiazol-3-yl]-N,N-diethyl-propan-1-amine

Systemtic Name: 3-[4-(4-bromophenyl)-2-(2-nitrophenyl)imino-1,3-thiazol-3-yl]-N,N-diethyl-propan-1-amine Openeye Name: 3-[4-(4-bromophenyl)-2-(2-nitrophenyl)imino-thiazol-3-yl]-N,N-diethyl-propan-1-amine CAS Name: 3-[4-(4-bromophenyl)-2-(2-nitrophenyl)imino-3-thiazolyl]-N,N-diethyl-1-propanamine IUPAC Name: 3-[4-(4-bromophenyl)-2-(2-nitrophenyl)imino-1,3-thiazol-3-yl]-N,N-diethylpropan-1-amine Traditional Name: 3-[4-(4-bromophenyl)-2-(2-nitrophenyl)imino-4-thiazolin-3-yl]propyl-diethyl-amine Formula: C22H25BrN4O2S MolecularWeight: 489.4285

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCCN1C(=CSC1=NC2=CC=CC=C2[N+](=O)[O-])C3=CC=C(C=C3)Br

Isomeric SMILES

CCN(CC)CCCN1C(=CSC1=NC2=CC=CC=C2[N+](=O)[O-])C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H25BrN4O2S/c1-3-25(4-2)14-7-15-26-21(17-10-12-18(23)13-11-17)16-30-22(26)24-19-8-5-6-9-20(19)27(28)29/h5-6,8-13,16H,3-4,7,14-15H2,1-2H3