2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-[(2,5-dimethylphenyl)amino]prop-2-enenitrile

Systemtic Name: 2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-[(2,5-dimethylphenyl)amino]prop-2-enenitrile Openeye Name: 2-[4-(4-bromophenyl)thiazol-2-yl]-3-(2,5-dimethylanilino)prop-2-enenitrile CAS Name: 2-[4-(4-bromophenyl)-2-thiazolyl]-3-(2,5-dimethylanilino)-2-propenenitrile IUPAC Name: 2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(2,5-dimethylanilino)prop-2-enenitrile Traditional Name: 2-[4-(4-bromophenyl)thiazol-2-yl]-3-(2,5-dimethylanilino)acrylonitrile Formula: C20H16BrN3S MolecularWeight: 410.33014

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C20H16BrN3S/c1-13-3-4-14(2)18(9-13)23-11-16(10-22)20-24-19(12-25-20)15-5-7-17(21)8-6-15/h3-9,11-12,23H,1-2H3