(Z)-3-(3-bromophenyl)-2-[5-(4-methoxyphenyl)carbonylthiophen-2-yl]prop-2-enenitrile

Systemtic Name: (Z)-3-(3-bromophenyl)-2-[5-(4-methoxyphenyl)carbonylthiophen-2-yl]prop-2-enenitrile Openeye Name: (Z)-3-(3-bromophenyl)-2-[5-(4-methoxybenzoyl)-2-thienyl]prop-2-enenitrile CAS Name: (Z)-3-(3-bromophenyl)-2-[5-[(4-methoxyphenyl)-oxomethyl]-2-thiophenyl]-2-propenenitrile IUPAC Name: (Z)-3-(3-bromophenyl)-2-[5-(4-methoxybenzoyl)thiophen-2-yl]prop-2-enenitrile Traditional Name: (Z)-3-(3-bromophenyl)-2-(5-p-anisoyl-2-thienyl)acrylonitrile Formula: C21H14BrNO2S MolecularWeight: 424.31036

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C2=CC=C(S2)C(=CC3=CC(=CC=C3)Br)C#N

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C2=CC=C(S2)/C(=C\C3=CC(=CC=C3)Br)/C#N

InChI

InChI=1S/C21H14BrNO2S/c1-25-18-7-5-15(6-8-18)21(24)20-10-9-19(26-20)16(13-23)11-14-3-2-4-17(22)12-14/h2-12H,1H3/b16-11-