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

Systemtic Name: 3-[(2-bromanyl-4-methyl-phenyl)amino]-2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile Openeye Name: 3-(2-bromo-4-methyl-anilino)-2-[4-(4-ethylphenyl)thiazol-2-yl]prop-2-enenitrile CAS Name: 3-(2-bromo-4-methylanilino)-2-[4-(4-ethylphenyl)-2-thiazolyl]-2-propenenitrile IUPAC Name: 3-(2-bromo-4-methylanilino)-2-[4-(4-ethylphenyl)-1,3-thiazol-2-yl]prop-2-enenitrile Traditional Name: 3-(2-bromo-4-methyl-anilino)-2-[4-(4-ethylphenyl)thiazol-2-yl]acrylonitrile Formula: C21H18BrN3S MolecularWeight: 424.35672

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=C(C=C(C=C3)C)Br)C#N

Isomeric SMILES

CCC1=CC=C(C=C1)C2=CSC(=N2)C(=CNC3=C(C=C(C=C3)C)Br)C#N

InChI

InChI=1S/C21H18BrN3S/c1-3-15-5-7-16(8-6-15)20-13-26-21(25-20)17(11-23)12-24-19-9-4-14(2)10-18(19)22/h4-10,12-13,24H,3H2,1-2H3