(Z)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(4-butoxyphenyl)prop-2-enenitrile

Systemtic Name: (Z)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(4-butoxyphenyl)prop-2-enenitrile Openeye Name: (Z)-2-[4-(4-bromophenyl)thiazol-2-yl]-3-(4-butoxyphenyl)prop-2-enenitrile CAS Name: (Z)-2-[4-(4-bromophenyl)-2-thiazolyl]-3-(4-butoxyphenyl)-2-propenenitrile IUPAC Name: (Z)-2-[4-(4-bromophenyl)-1,3-thiazol-2-yl]-3-(4-butoxyphenyl)prop-2-enenitrile Traditional Name: (Z)-2-[4-(4-bromophenyl)thiazol-2-yl]-3-(4-butoxyphenyl)acrylonitrile Formula: C22H19BrN2OS MolecularWeight: 439.36806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C=C(C#N)C2=NC(=CS2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCOC1=CC=C(C=C1)/C=C(/C#N)\C2=NC(=CS2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C22H19BrN2OS/c1-2-3-12-26-20-10-4-16(5-11-20)13-18(14-24)22-25-21(15-27-22)17-6-8-19(23)9-7-17/h4-11,13,15H,2-3,12H2,1H3/b18-13-