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

Systemtic Name: 3-[(2-bromanyl-4-methyl-phenyl)amino]-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile Openeye Name: 3-(2-bromo-4-methyl-anilino)-2-[4-(3-methoxyphenyl)thiazol-2-yl]prop-2-enenitrile CAS Name: 3-(2-bromo-4-methylanilino)-2-[4-(3-methoxyphenyl)-2-thiazolyl]-2-propenenitrile IUPAC Name: 3-(2-bromo-4-methylanilino)-2-[4-(3-methoxyphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile Traditional Name: 3-(2-bromo-4-methyl-anilino)-2-[4-(3-methoxyphenyl)thiazol-2-yl]acrylonitrile Formula: C20H16BrN3OS MolecularWeight: 426.32954

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H16BrN3OS/c1-13-6-7-18(17(21)8-13)23-11-15(10-22)20-24-19(12-26-20)14-4-3-5-16(9-14)25-2/h3-9,11-12,23H,1-2H3