2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-[(2-methyl-4-nitro-phenyl)amino]prop-2-enenitrile

Systemtic Name: 2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-[(2-methyl-4-nitro-phenyl)amino]prop-2-enenitrile Openeye Name: 2-[4-(3-bromophenyl)thiazol-2-yl]-3-(2-methyl-4-nitro-anilino)prop-2-enenitrile CAS Name: 2-[4-(3-bromophenyl)-2-thiazolyl]-3-(2-methyl-4-nitroanilino)-2-propenenitrile IUPAC Name: 2-[4-(3-bromophenyl)-1,3-thiazol-2-yl]-3-(2-methyl-4-nitroanilino)prop-2-enenitrile Traditional Name: 2-[4-(3-bromophenyl)thiazol-2-yl]-3-(2-methyl-4-nitro-anilino)acrylonitrile Formula: C19H13BrN4O2S MolecularWeight: 441.30112

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)Br

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC=C(C#N)C2=NC(=CS2)C3=CC(=CC=C3)Br

InChI

InChI=1S/C19H13BrN4O2S/c1-12-7-16(24(25)26)5-6-17(12)22-10-14(9-21)19-23-18(11-27-19)13-3-2-4-15(20)8-13/h2-8,10-11,22H,1H3