(E)-2-[4-(4-butylphenyl)-1,3-thiazol-2-yl]-3-(5-methylfuran-2-yl)prop-2-enenitrile

Systemtic Name: (E)-2-[4-(4-butylphenyl)-1,3-thiazol-2-yl]-3-(5-methylfuran-2-yl)prop-2-enenitrile Openeye Name: (E)-2-[4-(4-butylphenyl)thiazol-2-yl]-3-(5-methyl-2-furyl)prop-2-enenitrile CAS Name: (E)-2-[4-(4-butylphenyl)-2-thiazolyl]-3-(5-methyl-2-furanyl)-2-propenenitrile IUPAC Name: (E)-2-[4-(4-butylphenyl)-1,3-thiazol-2-yl]-3-(5-methylfuran-2-yl)prop-2-enenitrile Traditional Name: (E)-2-[4-(4-butylphenyl)thiazol-2-yl]-3-(5-methyl-2-furyl)acrylonitrile Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C2=CSC(=N2)C(=CC3=CC=C(O3)C)C#N

Isomeric SMILES

CCCCC1=CC=C(C=C1)C2=CSC(=N2)/C(=C/C3=CC=C(O3)C)/C#N

InChI

InChI=1S/C21H20N2OS/c1-3-4-5-16-7-9-17(10-8-16)20-14-25-21(23-20)18(13-22)12-19-11-6-15(2)24-19/h6-12,14H,3-5H2,1-2H3/b18-12+