2-diethylaminoethyl 4-[[2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-ethenyl]amino]benzoate

Systemtic Name: 2-diethylaminoethyl 4-[[2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyano-ethenyl]amino]benzoate Openeye Name: 2-diethylaminoethyl 4-[[2-[4-(3-bromophenyl)thiazol-2-yl]-2-cyano-vinyl]amino]benzoate CAS Name: 4-[[2-[4-(3-bromophenyl)-2-thiazolyl]-2-cyanoethenyl]amino]benzoic acid 2-diethylaminoethyl ester IUPAC Name: 2-diethylaminoethyl 4-[[2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-2-cyanoethenyl]amino]benzoate Traditional Name: 4-[[2-[4-(3-bromophenyl)thiazol-2-yl]-2-cyano-vinyl]amino]benzoic acid 2-diethylaminoethyl ester Formula: C25H25BrN4O2S MolecularWeight: 525.4606

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)Br

Isomeric SMILES

CCN(CC)CCOC(=O)C1=CC=C(C=C1)NC=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C25H25BrN4O2S/c1-3-30(4-2)12-13-32-25(31)18-8-10-22(11-9-18)28-16-20(15-27)24-29-23(17-33-24)19-6-5-7-21(26)14-19/h5-11,14,16-17,28H,3-4,12-13H2,1-2H3